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Home Carboxys 4H-Thieno[3,2-b]pyrrole-5-carboxylic acid

4H-Thieno[3,2-b]pyrrole-5-carboxylic acid

CAS No.:
39793-31-2
Catalog Number:
AG007786
Molecular Formula:
C7H5NO2S
Molecular Weight:
167.1851
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$138
- +
5g
98%
In Stock USA
United States
$500
- +
10g
98%
In Stock USA
United States
$875
- +
25g
98%
In Stock USA
United States
$1750
- +
Product Description
Catalog Number:
AG007786
Chemical Name:
4H-Thieno[3,2-b]pyrrole-5-carboxylic acid
CAS Number:
39793-31-2
Molecular Formula:
C7H5NO2S
Molecular Weight:
167.1851
MDL Number:
MFCD07368542
IUPAC Name:
4H-thieno[3,2-b]pyrrole-5-carboxylic acid
InChI:
InChI=1S/C7H5NO2S/c9-7(10)5-3-6-4(8-5)1-2-11-6/h1-3,8H,(H,9,10)
InChI Key:
PMHDSACGRKBACK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)ccs2
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.004g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
167.182g/mol
Monoisotopic Mass:
167.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
A series of D-amino acid oxidase inhibitors specifically prevents and reverses formalin-induced tonic pain in rats. The Journal of pharmacology and experimental therapeutics 20110101
Beyond the dopamine receptor: novel therapeutic targets for treating schizophrenia. Dialogues in clinical neuroscience 20100901
Virtual fragment screening for novel inhibitors of 6-phosphogluconate dehydrogenase. Bioorganic & medicinal chemistry 20100715
The Therapeutic Potential of D-Amino Acid Oxidase (DAAO) Inhibitors. The open medicinal chemistry journal 20100101
Commentary: genome-based CNS drug discovery: D-amino acid oxidase (DAAO) as a novel target for antipsychotic medications: progress and challenges. Biochemical pharmacology 20091201
The behavioral and neurochemical effects of a novel D-amino acid oxidase inhibitor compound 8 [4H-thieno [3,2-b]pyrrole-5-carboxylic acid] and D-serine. The Journal of pharmacology and experimental therapeutics 20090301
The discovery of fused pyrrole carboxylic acids as novel, potent D-amino acid oxidase (DAO) inhibitors. Bioorganic & medicinal chemistry letters 20080601
Properties