ethyl N-(4-chloro-3-nitrobenzene-1-sulfonyl)-N-[(4-chlorophenyl)methyl]-2-methylalaninate
Chemical Structure Depiction of
ethyl N-(4-chloro-3-nitrobenzene-1-sulfonyl)-N-[(4-chlorophenyl)methyl]-2-methylalaninate
ethyl N-(4-chloro-3-nitrobenzene-1-sulfonyl)-N-[(4-chlorophenyl)methyl]-2-methylalaninate
Compound characteristics
| Compound ID: | K784-2522 |
| Compound Name: | ethyl N-(4-chloro-3-nitrobenzene-1-sulfonyl)-N-[(4-chlorophenyl)methyl]-2-methylalaninate |
| Molecular Weight: | 475.35 |
| Molecular Formula: | C19 H20 Cl2 N2 O6 S |
| Smiles: | CCOC(C(C)(C)N(Cc1ccc(cc1)[Cl])S(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9084 |
| logD: | 4.9084 |
| logSw: | -4.9987 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.214 |
| InChI Key: | MVQBJPMUKCJWRA-UHFFFAOYSA-N |