ethyl 3-{(4-chlorobenzene-1-sulfonyl)[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoate
Chemical Structure Depiction of
ethyl 3-{(4-chlorobenzene-1-sulfonyl)[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoate
ethyl 3-{(4-chlorobenzene-1-sulfonyl)[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoate
Compound characteristics
| Compound ID: | K783-1229 |
| Compound Name: | ethyl 3-{(4-chlorobenzene-1-sulfonyl)[(4-chloro-3-nitrophenyl)methyl]amino}-4-methylpentanoate |
| Molecular Weight: | 503.4 |
| Molecular Formula: | C21 H24 Cl2 N2 O6 S |
| Smiles: | CCOC(CC(C(C)C)N(Cc1ccc(c(c1)[N+]([O-])=O)[Cl])S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.389 |
| logD: | 5.389 |
| logSw: | -5.8677 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.84 |
| InChI Key: | STZJJMMXGYXZMS-IBGZPJMESA-N |