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AT7519

CAS No.:
844442-38-2
Catalog Number:
AG00G3NK
Molecular Formula:
C16H17Cl2N5O2
Molecular Weight:
382.2445
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$140
- +
10mg
98%
1 week
United States
$182
- +
50mg
98%
1 week
United States
$321
- +
100mg
98%
1 week
United States
$404
- +
Product Description
Catalog Number:
AG00G3NK
Chemical Name:
AT7519
CAS Number:
844442-38-2
Molecular Formula:
C16H17Cl2N5O2
Molecular Weight:
382.2445
MDL Number:
MFCD13184820
IUPAC Name:
4-[(2,6-dichlorobenzoyl)amino]-N-piperidin-4-yl-1H-pyrazole-5-carboxamide
InChI:
InChI=1S/C16H17Cl2N5O2/c17-10-2-1-3-11(18)13(10)15(24)22-12-8-20-23-14(12)16(25)21-9-4-6-19-7-5-9/h1-3,8-9,19H,4-7H2,(H,20,23)(H,21,25)(H,22,24)
InChI Key:
OVPNQJVDAFNBDN-UHFFFAOYSA-N
SMILES:
O=C(c1[nH]ncc1NC(=O)c1c(Cl)cccc1Cl)NC1CCNCC1
UNII:
X1BF92PW9T
Properties
Complexity:
479  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.076g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
382.245g/mol
Monoisotopic Mass:
381.076g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
98.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Identification of potent Yes1 kinase inhibitors using a library screening approach. Bioorganic & medicinal chemistry letters 20130801
Cell cycle inhibition without disruption of neurogenesis is a strategy for treatment of aberrant cell cycle diseases: an update. TheScientificWorldJournal 20120101
Comprehensive analysis of kinase inhibitor selectivity. Nature biotechnology 20111030
A phase I pharmacokinetic and pharmacodynamic study of AT7519, a cyclin-dependent kinase inhibitor in patients with refractory solid tumors. Annals of oncology : official journal of the European Society for Medical Oncology 20110901
Prediction of cyclin-dependent kinase 2 inhibitor potency using the fragment molecular orbital method. Journal of cheminformatics 20110101
Induction of eosinophil apoptosis by the cyclin-dependent kinase inhibitor AT7519 promotes the resolution of eosinophil-dominant allergic inflammation. PloS one 20110101
Activation state-dependent binding of small molecule kinase inhibitors: structural insights from biochemistry. Chemistry & biology 20101124
AT7519, A novel small molecule multi-cyclin-dependent kinase inhibitor, induces apoptosis in multiple myeloma via GSK-3beta activation and RNA polymerase II inhibition. Oncogene 20100422
AT7519, a cyclin-dependent kinase inhibitor, exerts its effects by transcriptional inhibition in leukemia cell lines and patient samples. Molecular cancer therapeutics 20100401
Biological characterization of AT7519, a small-molecule inhibitor of cyclin-dependent kinases, in human tumor cell lines. Molecular cancer therapeutics 20090201
Identification of N-(4-piperidinyl)-4-(2,6-dichlorobenzoylamino)-1H-pyrazole-3-carboxamide (AT7519), a novel cyclin dependent kinase inhibitor using fragment-based X-ray crystallography and structure based drug design. Journal of medicinal chemistry 20080828
Properties