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
| 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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