N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-N~2~-(2-methylpropyl)glycinamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-N~2~-(2-methylpropyl)glycinamide
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-N~2~-(2-methylpropyl)glycinamide
Compound characteristics
| Compound ID: | V010-7631 |
| Compound Name: | N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-N~2~-(2-methylpropyl)glycinamide |
| Molecular Weight: | 557.71 |
| Molecular Formula: | C29 H39 N3 O6 S |
| Smiles: | CCS(N(CC(C)C)CC(N(Cc1ccc(C)cc1)C1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8431 |
| logD: | 3.8431 |
| logSw: | -3.8523 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.28 |
| InChI Key: | CJCFPUFNBHPLRQ-UHFFFAOYSA-N |