4-{benzyl[N-(2-methylpropyl)-N-(propane-1-sulfonyl)glycyl]amino}-N-(4-cyanophenyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-{benzyl[N-(2-methylpropyl)-N-(propane-1-sulfonyl)glycyl]amino}-N-(4-cyanophenyl)piperidine-1-carboxamide
4-{benzyl[N-(2-methylpropyl)-N-(propane-1-sulfonyl)glycyl]amino}-N-(4-cyanophenyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | V010-4100 |
| Compound Name: | 4-{benzyl[N-(2-methylpropyl)-N-(propane-1-sulfonyl)glycyl]amino}-N-(4-cyanophenyl)piperidine-1-carboxamide |
| Molecular Weight: | 553.72 |
| Molecular Formula: | C29 H39 N5 O4 S |
| Smiles: | CCCS(N(CC(C)C)CC(N(Cc1ccccc1)C1CCN(CC1)C(Nc1ccc(C#N)cc1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9424 |
| logD: | 3.9424 |
| logSw: | -3.9021 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.041 |
| InChI Key: | RANOBTIMBFLFPV-UHFFFAOYSA-N |