AC1N3OD4 structure

AC1N3OD4

2-methoxy-N-[3-oxo-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]benzamide

Also Known As: (Z)-N-((Z)-4-(azepan-2-ylidene)-5-oxo-1-phenylpyrazolidin-3-ylidene)-2-methoxybenzamide|N-[(3Z,4Z)-4-(azepan-2-ylidene)-5-oxo-1-phenylpyrazolidin-3-ylidene]-2-methoxybenzamide|2-methoxy-N-[3-oxo-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]benzamide|2-methoxy-N-[5-oxo-1-phenyl-4-(4,5,6,7-tetrahydro-3H-azepin-2-yl)-2H-pyrazol-3-yl]benzamide|N-[(3Z)-5-hydroxy-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1,2-dihydro-3H-pyrazol-3-ylidene]-2-methoxybenzamide|N-[5-hydroxy-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-3-yl]-2-methoxybenzamide

CAS: 326003-85-4
Molecular Formula C23H24N4O3
Molecular Weight 404.18484 g/mol
LogP 3.7896
Topological Polar Surface Area 88.48 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 404.18484
Monoisotopic Mass 404.18484
Heavy Atoms 30
Complexity 1128.85

Chemical Identifiers

CAS Number 326003-85-4
SMILES COC1=CC=CC=C1C(=O)NC2=C(C(=O)N(N2)C3=CC=CC=C3)C4=NCCCCC4

Product Overview

AC1N3OD4 (CAS 326003-85-4), with molecular formula C23H24N4O3 and molecular weight 404.18484 g/mol. IUPAC: 2-methoxy-N-[3-oxo-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]benzamide.

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