N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C387-0257 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C26 H23 N3 O5 |
| Smiles: | COc1ccc(c(c1)OC)Nc1cc(C(NCc2ccc3c(c2)OCO3)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2951 |
| logD: | 5.2817 |
| logSw: | -5.616 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.054 |
| InChI Key: | FAXFBGQQYRMANT-UHFFFAOYSA-N |