ethyl N-{[1-(5-chlorothiophen-2-yl)ethyl]carbamoyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{[1-(5-chlorothiophen-2-yl)ethyl]carbamoyl}-beta-alaninate
ethyl N-{[1-(5-chlorothiophen-2-yl)ethyl]carbamoyl}-beta-alaninate
Compound characteristics
| Compound ID: | Y207-0404 |
| Compound Name: | ethyl N-{[1-(5-chlorothiophen-2-yl)ethyl]carbamoyl}-beta-alaninate |
| Molecular Weight: | 304.79 |
| Molecular Formula: | C12 H17 Cl N2 O3 S |
| Smiles: | CCOC(CCNC(NC(C)c1ccc(s1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0812 |
| logD: | 2.0812 |
| logSw: | -2.856 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.639 |
| InChI Key: | KREZSJSJZRTPHX-QMMMGPOBSA-N |