AC1LWJZB structure

AC1LWJZB

methyl 2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Also Known As: CBMicro_018229|Oprea1_278543|BIM-0018094.P001|AK-968/37173284|methyl 2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 2-{[(3-chloro-6-methyl-1-benzothien-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 2-(3-chloro-6-methylbenzo[b]thiophene-2-carboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|methyl 2-[(3-chloro-6-methylbenzo[b]thiophen-2-yl)carbonylamino]-4,5,6,7-tetra hydrobenzo[b]thiophene-3-carboxylate|methyl 2-{[(3-chloro-6-methyl-1-benzothiophen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS: 312938-91-3
Molecular Formula C20H18ClNO3S2
Molecular Weight 419.04166 g/mol
LogP 5.84232
Topological Polar Surface Area 55.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 419.04166
Monoisotopic Mass 419.04166
Heavy Atoms 27
Complexity 1067.0416

Chemical Identifiers

CAS Number 312938-91-3
SMILES CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC)Cl

Product Overview

AC1LWJZB (CAS 312938-91-3), with molecular formula C20H18ClNO3S2 and molecular weight 419.04166 g/mol. IUPAC: methyl 2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.

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