AC1LLMLV
3-chloro-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide
Also Known As: BAS 06980930|BRD-K75427706-001-01-5|3-chloro-N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide|Benzo[b]thiophene-2-carboxamide,3-chloro-N-[5-[ methyl]-1,3,4-thiadiazol-2-yl]-|3-chloro-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide|3-CHLORO-N-{5-[(3,4-DIMETHOXYPHENYL)METHYL]-1,3,4-THIADIAZOL-2-YL}-1-BENZOTHIOPHENE-2-CARBOXAMIDE|BENZO[B]THIOPHENE-2-CARBOXAMIDE, 3-CHLORO-N-[5-[(3,4-DIMETHOXYPHENYL)METHYL]-1,3,4-THIADIAZOL-2-YL]-|Benzo[b]thiophene-2-carboxamide, 3-chloro-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]- (9CI)|benzo[b]thiophene-2-carboxamide,3-chloro-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-|N-{5-[(3,4-dimethoxyphenyl)methyl](1,3,4-thiadiazol-2-yl)}(3-chlorobenzo[b]thi ophen-2-yl)carboxamide
| Molecular Formula | C20H16ClN3O3S2 |
|---|---|
| Molecular Weight | 445.03217 g/mol |
| LogP | 5.2665 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.03217 |
| Monoisotopic Mass | 445.03217 |
| Heavy Atoms | 29 |
| Complexity | 1188.9047 |
Chemical Identifiers
| CAS Number | 600640-91-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)OC |
Product Overview
AC1LLMLV (CAS 600640-91-3), with molecular formula C20H16ClN3O3S2 and molecular weight 445.03217 g/mol. IUPAC: 3-chloro-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide.
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