N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-propanoylpiperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-propanoylpiperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-propanoylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y031-6412 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-propanoylpiperidine-4-carboxamide |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C17 H22 N2 O4 |
| Smiles: | CCC(N1CCC(CC1)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2313 |
| logD: | 1.2313 |
| logSw: | -2.1553 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.16 |
| InChI Key: | DNYCGTUOQKIAMG-UHFFFAOYSA-N |