ethyl 4-{[(2-methylpropyl)(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(2-methylpropyl)(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate
ethyl 4-{[(2-methylpropyl)(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate
Compound characteristics
| Compound ID: | K783-1296 |
| Compound Name: | ethyl 4-{[(2-methylpropyl)(4-nitrobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxylate |
| Molecular Weight: | 426.53 |
| Molecular Formula: | C20 H30 N2 O6 S |
| Smiles: | CCOC(C1CCC(CC1)CN(CC(C)C)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.963 |
| logD: | 4.963 |
| logSw: | -4.5348 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.941 |
| InChI Key: | GFGRGWGDFNIDPX-UHFFFAOYSA-N |