N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-3-carboxamide
N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | V010-1893 |
| Compound Name: | N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-3-carboxamide |
| Molecular Weight: | 508.57 |
| Molecular Formula: | C27 H32 N4 O6 |
| Smiles: | COc1ccc(cc1)C(N[C@@H]1CCCC[C@H]1NC(C1CCCN(C1)C(c1cccc(c1)[N+]([O-])=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.69 |
| logD: | 2.69 |
| logSw: | -3.0564 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.611 |
| InChI Key: | DXDPGUNQFAPASG-BMTNDILFSA-N |