2-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y205-1446 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 383.41 |
| Molecular Formula: | C23 H17 N3 O3 |
| Smiles: | C(c1ccncc1)NC(c1cc(c2ccc3c(c2)OCO3)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9614 |
| logD: | 3.958 |
| logSw: | -4.2775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.255 |
| InChI Key: | UVEHTUGJZZTLHR-UHFFFAOYSA-N |