N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-3-(4-methoxybenzamido)pyrazine-2-carboxamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-3-(4-methoxybenzamido)pyrazine-2-carboxamide
N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-3-(4-methoxybenzamido)pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | V022-7035 |
| Compound Name: | N-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-3-(4-methoxybenzamido)pyrazine-2-carboxamide |
| Molecular Weight: | 503.51 |
| Molecular Formula: | C26 H25 N5 O6 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)C(Nc1c(C(NC2CCN(CC2)C(c2ccc3c(c2)OCO3)=O)=O)nccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6634 |
| logD: | 0.9825 |
| logSw: | -2.1685 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.09 |
| InChI Key: | MJTKQVOZXLMRJB-UHFFFAOYSA-N |