AC1NVKF4 structure

AC1NVKF4

N-[3-(benzylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(2-hydroxyphenyl)-1H-pyrazole-5-carboxamide

Also Known As: N-[3-(benzylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(2-hydroxyphenyl)-1H-pyrazole-3-carboxamide|(5Z)-N-[3-(benzylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide|N-(3-(benzylcarbamoyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-3-(2-hydroxyphenyl)-1H-pyrazole-5-carboxamide|N-[3-(benzylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide

CAS: 879461-69-5
Molecular Formula C26H24N4O3S
Molecular Weight 472.15692 g/mol
LogP 4.9049
Topological Polar Surface Area 107.11 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 472.15692
Monoisotopic Mass 472.15692
Heavy Atoms 34
Complexity 1343.3469

Chemical Identifiers

CAS Number 879461-69-5
SMILES C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4O)C(=O)NCC5=CC=CC=C5

Product Overview

AC1NVKF4 (CAS 879461-69-5), with molecular formula C26H24N4O3S and molecular weight 472.15692 g/mol. IUPAC: N-[3-(benzylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(2-hydroxyphenyl)-1H-pyrazole-5-carboxamide.

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