N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-ethylanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-ethylanilino)quinoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-ethylanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C387-0495 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-ethylanilino)quinoline-4-carboxamide |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C26 H23 N3 O3 |
| Smiles: | CCc1ccccc1Nc1cc(C(NCc2ccc3c(c2)OCO3)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0495 |
| logD: | 6.049 |
| logSw: | -5.6947 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.88 |
| InChI Key: | RTUJFXFPKMQZFZ-UHFFFAOYSA-N |