N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-2-(pyridin-3-yl)quinoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | G547-0345 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 462.3 |
| Molecular Formula: | C23 H16 Br N3 O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1cc(c2cccnc2)nc2ccc(cc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8211 |
| logD: | 4.8164 |
| logSw: | -4.6745 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.344 |
| InChI Key: | WOXDBHWPXPNDQZ-UHFFFAOYSA-N |