N~3~-(4-chlorobenzene-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(4-chlorobenzene-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-beta-alaninamide
N~3~-(4-chlorobenzene-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-beta-alaninamide
Compound characteristics
| Compound ID: | K781-2061 |
| Compound Name: | N~3~-(4-chlorobenzene-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-beta-alaninamide |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C19 H23 Cl N2 O5 S |
| Smiles: | COc1ccc(CCNC(CCNS(c2ccc(cc2)[Cl])(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.1057 |
| logD: | 2.1057 |
| logSw: | -3.1188 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.412 |
| InChI Key: | LSHVCRTXLZVLMF-UHFFFAOYSA-N |