ethyl N-{[(3,4-dichlorophenyl)methyl]carbamoyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{[(3,4-dichlorophenyl)methyl]carbamoyl}-beta-alaninate
ethyl N-{[(3,4-dichlorophenyl)methyl]carbamoyl}-beta-alaninate
Compound characteristics
| Compound ID: | Y206-8676 |
| Compound Name: | ethyl N-{[(3,4-dichlorophenyl)methyl]carbamoyl}-beta-alaninate |
| Molecular Weight: | 319.19 |
| Molecular Formula: | C13 H16 Cl2 N2 O3 |
| Smiles: | CCOC(CCNC(NCc1ccc(c(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3694 |
| logD: | 2.3694 |
| logSw: | -3.1318 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.457 |
| InChI Key: | ZCFBDRVEUKJGKD-UHFFFAOYSA-N |