ethyl 4-{[benzyl(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[benzyl(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate
ethyl 4-{[benzyl(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate
Compound characteristics
| Compound ID: | K783-1142 |
| Compound Name: | ethyl 4-{[benzyl(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C23 H28 N2 O6 S |
| Smiles: | CCOC(C1CCC(CC1)CN(Cc1ccccc1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.24 |
| logD: | 5.24 |
| logSw: | -5.1108 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.67 |
| InChI Key: | OSHLNLJZZDUYAQ-UHFFFAOYSA-N |