N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-cyanobenzoyl)-4-methylpiperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-cyanobenzoyl)-4-methylpiperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-cyanobenzoyl)-4-methylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | F709-0603 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-cyanobenzoyl)-4-methylpiperidine-4-carboxamide |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C23 H23 N3 O4 |
| Smiles: | CC1(CCN(CC1)C(c1ccc(C#N)cc1)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2589 |
| logD: | 2.2589 |
| logSw: | -2.8271 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.472 |
| InChI Key: | ZNCYADUUCDVVKD-UHFFFAOYSA-N |