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6846-13-5

6846-13-5 | Thiophene-2-carboxylic acid phenylamide

CAS No: 6846-13-5 Catalog No: AG01FCH5 MDL No:

Product Description

Catalog Number:
AG01FCH5
Chemical Name:
Thiophene-2-carboxylic acid phenylamide
CAS Number:
6846-13-5
Molecular Formula:
C11H9NOS
Molecular Weight:
203.2603
IUPAC Name:
N-phenylthiophene-2-carboxamide
InChI:
InChI=1S/C11H9NOS/c13-11(10-7-4-8-14-10)12-9-5-2-1-3-6-9/h1-8H,(H,12,13)
InChI Key:
WHWPJUQTGCHISO-UHFFFAOYSA-N
SMILES:
O=C(c1cccs1)Nc1ccccc1

Properties

Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.259g/mol
Monoisotopic Mass:
203.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Literature

Title Journal
Conformation study of 2-arylbenzimidazoles as inhibitors of Chlamydia pneumoniae growth. Bioorganic & medicinal chemistry letters 20120715

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