N-{4-[(pyridin-4-yl)methyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{4-[(pyridin-4-yl)methyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
N-{4-[(pyridin-4-yl)methyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | 8015-0969 |
| Compound Name: | N-{4-[(pyridin-4-yl)methyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 332.36 |
| Molecular Formula: | C20 H16 N2 O3 |
| Smiles: | C(c1ccc(cc1)NC(c1ccc2c(c1)OCO2)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 3.259 |
| logD: | 3.259 |
| logSw: | -3.3451 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.602 |
| InChI Key: | ZUPLNXYPFNFYDP-UHFFFAOYSA-N |