N~3~-(4-chlorobenzene-1-sulfonyl)-N-[(2-chloro-4-fluorophenyl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(4-chlorobenzene-1-sulfonyl)-N-[(2-chloro-4-fluorophenyl)methyl]-beta-alaninamide
N~3~-(4-chlorobenzene-1-sulfonyl)-N-[(2-chloro-4-fluorophenyl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | K786-5316 |
| Compound Name: | N~3~-(4-chlorobenzene-1-sulfonyl)-N-[(2-chloro-4-fluorophenyl)methyl]-beta-alaninamide |
| Molecular Weight: | 405.27 |
| Molecular Formula: | C16 H15 Cl2 F N2 O3 S |
| Smiles: | C(CNS(c1ccc(cc1)[Cl])(=O)=O)C(NCc1ccc(cc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8369 |
| logD: | 3.8368 |
| logSw: | -4.1819 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.31 |
| InChI Key: | YOWPCZCUQOVBRT-UHFFFAOYSA-N |