N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzoyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzoyl)piperidine-4-carboxamide
N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzoyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V012-1085 |
| Compound Name: | N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzoyl)piperidine-4-carboxamide |
| Molecular Weight: | 478.55 |
| Molecular Formula: | C26 H30 N4 O5 |
| Smiles: | C1CC[C@H]([C@@H](C1)NC(C1CCN(CC1)C(c1ccc(cc1)[N+]([O-])=O)=O)=O)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5763 |
| logD: | 2.5763 |
| logSw: | -2.8286 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.133 |
| InChI Key: | BVORNSLFRLPOKO-GOTSBHOMSA-N |