N-benzyl-N~2~-(2-methylpropyl)-N-[1-(3-nitrobenzoyl)piperidin-4-yl]-N~2~-(propane-1-sulfonyl)glycinamide
Chemical Structure Depiction of
N-benzyl-N~2~-(2-methylpropyl)-N-[1-(3-nitrobenzoyl)piperidin-4-yl]-N~2~-(propane-1-sulfonyl)glycinamide
N-benzyl-N~2~-(2-methylpropyl)-N-[1-(3-nitrobenzoyl)piperidin-4-yl]-N~2~-(propane-1-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | V010-4179 |
| Compound Name: | N-benzyl-N~2~-(2-methylpropyl)-N-[1-(3-nitrobenzoyl)piperidin-4-yl]-N~2~-(propane-1-sulfonyl)glycinamide |
| Molecular Weight: | 558.7 |
| Molecular Formula: | C28 H38 N4 O6 S |
| Smiles: | CCCS(N(CC(C)C)CC(N(Cc1ccccc1)C1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7895 |
| logD: | 3.7895 |
| logSw: | -3.8476 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.546 |
| InChI Key: | BLVBYPGHQDFHSP-UHFFFAOYSA-N |