2-(2H-1,3-benzodioxol-5-yl)-N-[(3,5-dimethylphenyl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[(3,5-dimethylphenyl)methyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[(3,5-dimethylphenyl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | V015-3791 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[(3,5-dimethylphenyl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C26 H22 N2 O3 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(CNC(c2cc(c3ccc4c(c3)OCO4)nc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.7173 |
| logD: | 6.7164 |
| logSw: | -5.8347 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.826 |
| InChI Key: | XMICYYSPVKNRIF-UHFFFAOYSA-N |