ethyl N-(4-chlorobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-chlorobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate
ethyl N-(4-chlorobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate
Compound characteristics
| Compound ID: | K783-1438 |
| Compound Name: | ethyl N-(4-chlorobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate |
| Molecular Weight: | 450.77 |
| Molecular Formula: | C18 H18 Cl3 N O4 S |
| Smiles: | CCOC(CCN(Cc1c(cccc1[Cl])[Cl])S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2135 |
| logD: | 5.2135 |
| logSw: | -5.5984 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.751 |
| InChI Key: | WRUJCGDNMGSKFZ-UHFFFAOYSA-N |