Name: Name:4H-Thieno[3,2-b]pyrrole-5-carboxylic acid, 2-chloro-
Brand: Angene
SKU: AG00I6GW
Rating: 90 (10 reviews)

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

CAS No.:

332099-40-8

Catalog Number:

AG00I6GW

Molecular Formula:

C7H4ClNO2S

Molecular Weight:

201.6302

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Product Description

Catalog Number:

AG00I6GW

Chemical Name:

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

CAS Number:

332099-40-8

Molecular Formula:

C7H4ClNO2S

Molecular Weight:

201.6302

MDL Number:

MFCD11109753

IUPAC Name:

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

InChI:

InChI=1S/C7H4ClNO2S/c8-6-2-3-5(12-6)1-4(9-3)7(10)11/h1-2,9H,(H,10,11)

InChI Key:

OWJRYNILRVVVFK-UHFFFAOYSA-N

SMILES:

Clc1sc2c(c1)[nH]c(c2)C(=O)O

Properties

Complexity:

214

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

200.965g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

201.624g/mol

Monoisotopic Mass:

200.965g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6

Literature

Title	Journal
The discovery of fused pyrrole carboxylic acids as novel, potent D-amino acid oxidase (DAO) inhibitors.	Bioorganic & medicinal chemistry letters 20080601