N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(3-fluorophenyl)methyl]-N~2~-(2-methoxyethyl)glycinamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(3-fluorophenyl)methyl]-N~2~-(2-methoxyethyl)glycinamide
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(3-fluorophenyl)methyl]-N~2~-(2-methoxyethyl)glycinamide
Compound characteristics
| Compound ID: | V001-3399 |
| Compound Name: | N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N~2~-(ethanesulfonyl)-N-[(3-fluorophenyl)methyl]-N~2~-(2-methoxyethyl)glycinamide |
| Molecular Weight: | 563.65 |
| Molecular Formula: | C27 H34 F N3 O7 S |
| Smiles: | CCS(N(CCOC)CC(N(Cc1cccc(c1)F)C1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2458 |
| logD: | 2.2458 |
| logSw: | -2.7634 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.601 |
| InChI Key: | KYBHWPCDBFIBBR-UHFFFAOYSA-N |