ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(4-chlorophenyl)-5-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(4-chlorophenyl)-5-methylthiophene-3-carboxylate
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(4-chlorophenyl)-5-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6344 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(4-chlorophenyl)-5-methylthiophene-3-carboxylate |
| Molecular Weight: | 443.9 |
| Molecular Formula: | C22 H18 Cl N O5 S |
| Smiles: | CCOC(c1c(c2ccc(cc2)[Cl])c(C)sc1NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5716 |
| logD: | 5.1707 |
| logSw: | -6.1479 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.722 |
| InChI Key: | QSKASFWQXOSUET-UHFFFAOYSA-N |