ethyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-{[(methylsulfanyl)carbonothioyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-{[(methylsulfanyl)carbonothioyl]amino}thiophene-3-carboxylate
ethyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-{[(methylsulfanyl)carbonothioyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | K285-0063 |
| Compound Name: | ethyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-{[(methylsulfanyl)carbonothioyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 428.98 |
| Molecular Formula: | C17 H17 Cl N2 O3 S3 |
| Smiles: | CCOC(c1c(C)c(C(Nc2cccc(c2)[Cl])=O)sc1NC(=S)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8383 |
| logD: | 0.0351 |
| logSw: | -4.9435 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.184 |
| InChI Key: | AVPGNOSFKQISRT-UHFFFAOYSA-N |