3-Amino-4-(4-methoxyphenyl)-6-(p-tolyl)-N-(2-(trifluoromethyl)phenyl)thieno[2,3-b]pyridine-2-carboxamide

HCID 178774174

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Basic information

CAS: 332155-24-5
Standard SMILES: COc1ccc(-c2cc(-c3ccc(C)cc3)nc3sc(C(=O)Nc4ccccc4C(F)(F)F)c(N)c23)cc1
InChIKey: QECCDCHFNZNBTN-UHFFFAOYSA-N
Molecular formula: C29H22F3N3O2S
Average molar mass: 533.6 g/mol

Names & identifiers

Preferred name: 3-Amino-4-(4-methoxyphenyl)-6-(p-tolyl)-N-(2-(trifluoromethyl)phenyl)thieno[2,3-b]pyridine-2-carboxamide
IUPAC: 3-amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)-N-[2-(trifluoromethyl)phenyl]thieno[2,3-b]pyridine-2-carboxamide
English name: 3-amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)-N-[2-(trifluoromethyl)phenyl]thieno[2,3-b]pyridine-2-carboxamide
Molecular formula: C29H22F3N3O2S
Molecular weight: 533.5640896

Names & synonyms

332155-24-53-Amino-4-(4-methoxyphenyl)-6-(p-tolyl)-N-(2-(trifluoromethyl)phenyl)thieno[2,3-b]pyridine-2-carboxamide3-amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)-N-[2-(trifluoromethyl)phenyl]thieno[2,3-b]pyridine-2-carboxamideAKOS000566182ST50249137AG-690/13703164[3-amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)thiopheno[2,3-b]pyridin-2-yl]-N -[2-(trifluoromethyl)phenyl]carboxamide3-Amino-4-(4-methoxy-phenyl)-6-p-tolyl-thieno[2,3-b]pyridine-2-carboxylic acid (2-trifluoromethyl-phenyl)-amide

Database identifiers

CAS: 332155-24-5

Properties

Computed structural properties

XLogP: 7.8
Topological polar surface area: 105 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 5
Heavy atoms: 38
Formal charge: 0
Complexity: 800

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