ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-phenylthiophene-3-carboxylate
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-1738 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-phenylthiophene-3-carboxylate |
| Molecular Weight: | 395.43 |
| Molecular Formula: | C21 H17 N O5 S |
| Smiles: | CCOC(c1c(csc1NC(c1ccc2c(c1)OCO2)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.484 |
| logD: | 4.432 |
| logSw: | -4.3908 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.722 |
| InChI Key: | RUPUSIJAZNJOKI-UHFFFAOYSA-N |