Home Other Building Blocks 1,2,3,6-Tetrahydro-1,3-dimethyl-N-[4-(1-methylethyl)phenyl]-2,6-dioxo-7H-purine-7-acetamide

1,2,3,6-Tetrahydro-1,3-dimethyl-N-[4-(1-methylethyl)phenyl]-2,6-dioxo-7H-purine-7-acetamide

CAS No.:
349085-38-7
Catalog Number:
AG0037ND
Molecular Formula:
C18H21N5O3
Molecular Weight:
355.3910
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$97
- +
10mg
≥98%
1 week
United States
$125
- +
50mg
95%
1 week
United States
$223
- +
100mg
95%
1 week
United States
$307
- +
Product Description
Catalog Number:
AG0037ND
Chemical Name:
1,2,3,6-Tetrahydro-1,3-dimethyl-N-[4-(1-methylethyl)phenyl]-2,6-dioxo-7H-purine-7-acetamide
CAS Number:
349085-38-7
Molecular Formula:
C18H21N5O3
Molecular Weight:
355.3910
MDL Number:
MFCD02007349
IUPAC Name:
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-propan-2-ylphenyl)acetamide
InChI:
InChI=1S/C18H21N5O3/c1-11(2)12-5-7-13(8-6-12)20-14(24)9-23-10-19-16-15(23)17(25)22(4)18(26)21(16)3/h5-8,10-11H,9H2,1-4H3,(H,20,24)
InChI Key:
HEQDZPHDVAOBLN-UHFFFAOYSA-N
SMILES:
O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1ccc(cc1)C(C)C
Properties
Complexity:
573  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.164g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
355.398g/mol
Monoisotopic Mass:
355.164g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
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Activation of TRPV3 by Wood Smoke Particles and Roles in Pneumotoxicity. Chemical research in toxicology 20180521
Zebrafish Locomotor Responses Reveal Irritant Effects of Fine Particulate Matter Extracts and a Role for TRPA1. Toxicological sciences : an official journal of the Society of Toxicology 20180201
Role of TRPA1 in acute cardiopulmonary toxicity of inhaled acrolein. Toxicology and applied pharmacology 20170601
Carvacrol reduces irinotecan-induced intestinal mucositis through inhibition of inflammation and oxidative damage via TRPA1 receptor activation. Chemico-biological interactions 20161225
Effects of Food Components That Activate TRPA1 Receptors on Mucosal Ion Transport in the Mouse Intestine. Nutrients 20161001
Activation of transient receptor potential ankyrin-1 (TRPA1) in lung cells by wood smoke particulate material. Chemical research in toxicology 20130520
Antagonism of the transient receptor potential ankyrin 1 (TRPA1) attenuates hyperalgesia and urinary bladder overactivity in cyclophosphamide-induced haemorrhagic cystitis. Chemico-biological interactions 20130425
Lack of transient receptor potential melastatin 8 activation by phthalate esters that enhance contact hypersensitivity in mice. Toxicology letters 20130313
Stimulation of human TRPA1 channels by clinical concentrations of the antirheumatic drug auranofin. American journal of physiology. Cell physiology 20130215
Role of transient receptor potential ion channels and evoked levels of neuropeptides in a formaldehyde-induced model of asthma in BALB/c mice. PloS one 20130101
Transient receptor potential ankyrin 1 activation enhances hapten sensitization in a T-helper type 2-driven fluorescein isothiocyanate-induced contact hypersensitivity mouse model. Toxicology and applied pharmacology 20121101
Involvement of the endogenous hydrogen sulfide/Ca(v) 3.2 T-type Ca2+ channel pathway in cystitis-related bladder pain in mice. British journal of pharmacology 20121001
Transient receptor potential channels mediate the tussive response to prostaglandin E2 and bradykinin. Thorax 20121001
Analysis of transient receptor potential ankyrin 1 (TRPA1) in frogs and lizards illuminates both nociceptive heat and chemical sensitivities and coexpression with TRP vanilloid 1 (TRPV1) in ancestral vertebrates. The Journal of biological chemistry 20120831
TRPA1-like channels enhance glycinergic transmission in medullary dorsal horn neurons. Journal of neurochemistry 20120801
Transient receptor potential canonical 3 (TRPC3) is required for IgG immune complex-induced excitation of the rat dorsal root ganglion neurons. The Journal of neuroscience : the official journal of the Society for Neuroscience 20120711
TRPA1 is functionally expressed in melanoma cells but is not critical for impaired proliferation caused by allyl isothiocyanate or cinnamaldehyde. Naunyn-Schmiedeberg's archives of pharmacology 20120601
Presynaptic enhancement by eugenol of spontaneous excitatory transmission in rat spinal substantia gelatinosa neurons is mediated by transient receptor potential A1 channels. Neuroscience 20120517
TRPA1 and TRPV4 mediate paclitaxel-induced peripheral neuropathy in mice via a glutathione-sensitive mechanism. Pflugers Archiv : European journal of physiology 20120401
Activation of transient receptor potential ankyrin 1 evokes nociception through substance P release from primary sensory neurons. Journal of neurochemistry 20120301
Ocular dryness excites two classes of corneal afferent neurons implicated in basal tearing in rats: involvement of transient receptor potential channels. Journal of neurophysiology 20120215
Tricyclic 3,4-dihydropyrimidine-2-thione derivatives as potent TRPA1 antagonists. Bioorganic & medicinal chemistry letters 20120115
A role for sensory nerves in the late asthmatic response. Thorax 20120101
TRPA1 contributes to the acute inflammatory response and mediates carrageenan-induced paw edema in the mouse. Scientific reports 20120101
Sensitivity of bronchopulmonary receptors to cold and heat mediated by transient receptor potential cation channel subtypes in an ex vivo rat lung preparation. Respiratory physiology & neurobiology 20110815
Transient receptor potential ankyrin 1 is expressed by inhibitory motoneurons of the mouse intestine. Gastroenterology 20110801
TRPA1 contributes to specific mechanically activated currents and sensory neuron mechanical hypersensitivity. The Journal of physiology 20110715
Oxaliplatin elicits mechanical and cold allodynia in rodents via TRPA1 receptor stimulation. Pain 20110701
The involvement of TRPA1 channel activation in the inflammatory response evoked by topical application of cinnamaldehyde to mice. Life sciences 20110620
TRPA1 receptor modulation attenuates bladder overactivity induced by spinal cord injury. American journal of physiology. Renal physiology 20110501
Synergistic role of TRPV1 and TRPA1 in pancreatic pain and inflammation. Gastroenterology 20110401
Human dental pulp fibroblasts express the 'cold-sensing' transient receptor potential channels TRPA1 and TRPM8. Journal of endodontics 20110401
Spinal transient receptor potential ankyrin 1 channel contributes to central pain hypersensitivity in various pathophysiological conditions in the rat. Pain 20110301
TRPA1 receptors mediate environmental irritant-induced meningeal vasodilatation. Pain 20110101
Acetaminophen, via its reactive metabolite N-acetyl-p-benzo-quinoneimine and transient receptor potential ankyrin-1 stimulation, causes neurogenic inflammation in the airways and other tissues in rodents. FASEB journal : official publication of the Federation of American Societies for Experimental Biology 20101201
Transient receptor potential ankyrin 1 (TRPA1) channel as emerging target for novel analgesics and anti-inflammatory agents. Journal of medicinal chemistry 20100722
Chemo-nociceptive signalling from the colon is enhanced by mild colitis and blocked by inhibition of transient receptor potential ankyrin 1 channels. British journal of pharmacology 20100701
Nitro-oleic acid inhibits firing and activates TRPV1- and TRPA1-mediated inward currents in dorsal root ganglion neurons from adult male rats. The Journal of pharmacology and experimental therapeutics 20100601
Involvement of TRPA1 in ET-1-induced pain-like behavior in mice. Neuroreport 20100217
Transient receptor potential ankyrin receptor 1 is a novel target for pro-tussive agents. British journal of pharmacology 20091101
Mediating roles of the vanilloid receptor TRPV1 in activation of rat primary afferent nociceptive neurons by formaldehyde. Sheng li xue bao : [Acta physiologica Sinica] 20091025
A sensory neuronal ion channel essential for airway inflammation and hyperreactivity in asthma. Proceedings of the National Academy of Sciences of the United States of America 20090602
HC-030031, a TRPA1 selective antagonist, attenuates inflammatory- and neuropathy-induced mechanical hypersensitivity. Molecular pain 20080101
TRPA1 mediates formalin-induced pain. Proceedings of the National Academy of Sciences of the United States of America 20070814
Properties