N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-4-carboxamide
N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V028-7473 |
| Compound Name: | N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]-1-(3-nitrobenzoyl)piperidine-4-carboxamide |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C27 H32 N4 O5 |
| Smiles: | Cc1ccccc1C(N[C@@H]1CCCC[C@H]1NC(C1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.1448 |
| logD: | 3.1448 |
| logSw: | -3.5542 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.133 |
| InChI Key: | XZGQQQFOTOPUPS-ZEQRLZLVSA-N |