ethyl N-(4-bromobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-bromobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate
ethyl N-(4-bromobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate
Compound characteristics
| Compound ID: | K783-1434 |
| Compound Name: | ethyl N-(4-bromobenzene-1-sulfonyl)-N-[(2,6-dichlorophenyl)methyl]-beta-alaninate |
| Molecular Weight: | 495.22 |
| Molecular Formula: | C18 H18 Br Cl2 N O4 S |
| Smiles: | CCOC(CCN(Cc1c(cccc1[Cl])[Cl])S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4526 |
| logD: | 5.4526 |
| logSw: | -5.8175 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.751 |
| InChI Key: | SYQSXNOQNKMROX-UHFFFAOYSA-N |