AC1MQQ9P structure

AC1MQQ9P

4-[bis(2-cyanoethyl)sulfamoyl]-N-[6-chloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide

Also Known As: F1359-0571|(Z)-4-(N,N-bis(2-cyanoethyl)sulfamoyl)-N-(6-chloro-3-(2-methoxyethyl)benzo[d]thiazol-2(3H)-ylidene)benzamide|4-[bis(2-cyanoethyl)sulfamoyl]-N-[(2Z)-6-chloro-3-(2-methoxyethyl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzamide|4-[bis(2-cyanoethyl)sulfamoyl]-N-[6-chloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide|4-[bis(2-cyanoethyl)sulfamoyl]-N-[6-chloro-3-(2-methoxyethyl)benzothiazol-2-ylidene]benzamide

CAS: 864975-75-7
Molecular Formula C23H22ClN5O4S2
Molecular Weight 531.0802 g/mol
LogP 3.56176
Topological Polar Surface Area 128.55 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 10
Exact Mass 531.0802
Monoisotopic Mass 531.0802
Heavy Atoms 35
Complexity 1446.7802

Chemical Identifiers

CAS Number 864975-75-7
SMILES COCCN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

Product Overview

AC1MQQ9P (CAS 864975-75-7), with molecular formula C23H22ClN5O4S2 and molecular weight 531.0802 g/mol. IUPAC: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[6-chloro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]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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