ethyl N-[(3-chlorophenyl)methyl]-2-methyl-N-(3-nitrobenzene-1-sulfonyl)alaninate
Chemical Structure Depiction of
ethyl N-[(3-chlorophenyl)methyl]-2-methyl-N-(3-nitrobenzene-1-sulfonyl)alaninate
ethyl N-[(3-chlorophenyl)methyl]-2-methyl-N-(3-nitrobenzene-1-sulfonyl)alaninate
Compound characteristics
| Compound ID: | K784-2519 |
| Compound Name: | ethyl N-[(3-chlorophenyl)methyl]-2-methyl-N-(3-nitrobenzene-1-sulfonyl)alaninate |
| Molecular Weight: | 440.9 |
| Molecular Formula: | C19 H21 Cl N2 O6 S |
| Smiles: | CCOC(C(C)(C)N(Cc1cccc(c1)[Cl])S(c1cccc(c1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3922 |
| logD: | 4.3922 |
| logSw: | -4.5181 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.515 |
| InChI Key: | HYWVEWKZDJYSFJ-UHFFFAOYSA-N |