4-{[N-(ethanesulfonyl)-N-(2-methylpropyl)glycyl][(4-methylphenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-{[N-(ethanesulfonyl)-N-(2-methylpropyl)glycyl][(4-methylphenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide
4-{[N-(ethanesulfonyl)-N-(2-methylpropyl)glycyl][(4-methylphenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | V010-7644 |
| Compound Name: | 4-{[N-(ethanesulfonyl)-N-(2-methylpropyl)glycyl][(4-methylphenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide |
| Molecular Weight: | 573.71 |
| Molecular Formula: | C28 H39 N5 O6 S |
| Smiles: | CCS(N(CC(C)C)CC(N(Cc1ccc(C)cc1)C1CCN(CC1)C(Nc1ccc(cc1)[N+]([O-])=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2908 |
| logD: | 4.2907 |
| logSw: | -4.0676 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.367 |
| InChI Key: | QCLVGOIVKIQMJK-UHFFFAOYSA-N |