AC1N3X1G structure

AC1N3X1G

4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-[4-[[4-[bis(2-cyanoethyl)sulfamoyl]benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide

Also Known As: F0289-0198|4-[bis(2-cyanoethyl)sulfamoyl]-N-(4'-{4-[bis(2-cyanoethyl)sulfamoyl]benzamido}-3,3'-dimethoxy-[1,1'-biphenyl]-4-yl)benzamide|N,N'-(3,3'-dimethoxy-[1,1'-biphenyl]-4,4'-diyl)bis(4-(N,N-bis(2-cyanoethyl)sulfamoyl)benzamide)|4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-[4-[[4-[bis(2-cyanoethyl)sulfamoyl]benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide

CAS: 392236-37-2
Molecular Formula C40H38N8O8S2
Molecular Weight 822.2254 g/mol
LogP 5.51152
Topological Polar Surface Area 246.58 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 12
Rotatable Bonds 19
Exact Mass 822.2254
Monoisotopic Mass 822.2254
Heavy Atoms 58
Complexity 2306.8896

Chemical Identifiers

CAS Number 392236-37-2
SMILES COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N)OC)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(CCC#N)CCC#N

Product Overview

AC1N3X1G (CAS 392236-37-2), with molecular formula C40H38N8O8S2 and molecular weight 822.2254 g/mol. IUPAC: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-[4-[[4-[bis(2-cyanoethyl)sulfamoyl]benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide.

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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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