N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N-[(3-chlorophenyl)methyl]-N~2~-(2-methoxyethyl)-N~2~-(propane-1-sulfonyl)glycinamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N-[(3-chlorophenyl)methyl]-N~2~-(2-methoxyethyl)-N~2~-(propane-1-sulfonyl)glycinamide
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N-[(3-chlorophenyl)methyl]-N~2~-(2-methoxyethyl)-N~2~-(propane-1-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | V001-1856 |
| Compound Name: | N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N-[(3-chlorophenyl)methyl]-N~2~-(2-methoxyethyl)-N~2~-(propane-1-sulfonyl)glycinamide |
| Molecular Weight: | 594.13 |
| Molecular Formula: | C28 H36 Cl N3 O7 S |
| Smiles: | CCCS(N(CCOC)CC(N(Cc1cccc(c1)[Cl])C1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1254 |
| logD: | 3.1254 |
| logSw: | -3.4498 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.601 |
| InChI Key: | YWOLOCXADCWMJZ-UHFFFAOYSA-N |