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N-(Pyrazin-2-yl)benzo[b]thiophene-3-carboxamide

HCID 178763392
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Basic information

CAS
717873-63-7
Standard SMILES
O=C(Nc1cnccn1)c1csc2ccccc12
InChIKey
OOZUJPYLBZSMCV-UHFFFAOYSA-N
Molecular formula
C13H9N3OS
Average molar mass
255.3 g/mol

Names & identifiers

Preferred name
N-(Pyrazin-2-yl)benzo[b]thiophene-3-carboxamide
IUPAC
N-pyrazin-2-yl-1-benzothiophene-3-carboxamide
English name
Benzo[b]thiophene-3-carboxamide, N-pyrazinyl- (9CI)
Molecular formula
C13H9N3OS
Molecular weight
255.29506

Names & synonyms

717873-63-7N-(Pyrazin-2-yl)benzo[b]thiophene-3-carboxamideN-(pyrazin-2-yl)-1-benzothiophene-3-carboxamideMLS000099828CHEMBL1595153HMS2465H13STK462833AKOS003346920SMR000080824ST50834499N-2-pyrazinyl-1-benzothiophene-3-carboxamidebenzo[b]thiophen-3-yl-N-pyrazin-2-ylcarboxamide
Show more names
Benzo[b]thiophene-3-carboxamide, N-pyrazinyl- (9CI)
SR-01000292816SR-01000292816-1

Database identifiers

CAS
717873-63-7
ChEMBL
CHEMBL1595153

Properties

Computed structural properties

XLogP
2
Topological polar surface area
83.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
313

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