AC1O0P8N structure

AC1O0P8N

(E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]prop-2-enamide

Also Known As: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]prop-2-enamide|N-{4-[(azepan-2-ylidene)sulfamoyl]phenyl}-2-cyano-3-(4-methoxyphenyl)prop-2-enamide

CAS: 326022-96-2
Molecular Formula C23H24N4O4S
Molecular Weight 452.15182 g/mol
LogP 3.49168
Topological Polar Surface Area 120.65 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 452.15182
Monoisotopic Mass 452.15182
Heavy Atoms 32
Complexity 1161.9723

Chemical Identifiers

CAS Number 326022-96-2
SMILES COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NCCCCC3

Product Overview

AC1O0P8N (CAS 326022-96-2), with molecular formula C23H24N4O4S and molecular weight 452.15182 g/mol. IUPAC: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]prop-2-enamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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