CBMicro_046544
methyl 2-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-5-methylthiophene-3-carboxylate
Also Known As: CBMicro_046544|Oprea1_872965|BIM-0046645.P001|methyl 2-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-5-methylthiophene-3-carboxylate|METHYL 2-[(3,6-DICHLOROBENZOTHIOPHENE-2-CARBONYL)AMINO]-5-METHYL-THIOPHENE-3-CARBOXYLATE|Methyl 2-(3,6-dichloro-1-benzothiophene-2-carboxamido)-5-methylthiophene-3-carboxylate|methyl 2-{[(3,6-dichloro-1-benzothien-2-yl)carbonyl]amino}-5-methyl-3-thiophenecarboxylate|methyl 2-[(3,6-dichlorobenzo[b]thiophen-2-yl)carbonylamino]-5-methylthiophene- 3-carboxylate|methyl 2-{[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]amino}-5-methylthiophene-3-carboxylate
| Molecular Formula | C16H11Cl2NO3S2 |
|---|---|
| Molecular Weight | 398.95575 g/mol |
| LogP | 5.61692 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.95575 |
| Monoisotopic Mass | 398.95575 |
| Heavy Atoms | 24 |
| Complexity | 961.7876 |
Chemical Identifiers
| CAS Number | 6131-30-2 |
|---|---|
| SMILES | CC1=CC(=C(S1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C(=O)OC |
Product Overview
CBMicro_046544 (CAS 6131-30-2), with molecular formula C16H11Cl2NO3S2 and molecular weight 398.95575 g/mol. IUPAC: methyl 2-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-5-methylthiophene-3-carboxylate.
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