ethyl 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate
ethyl 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate
Compound characteristics
| Compound ID: | C053-0314 |
| Compound Name: | ethyl 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate |
| Molecular Weight: | 418.37 |
| Molecular Formula: | C21 H17 F3 N2 O4 |
| Smiles: | CCOC(c1cnc2cc(ccc2c1Nc1ccc2c(c1)OCCO2)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1133 |
| logD: | 4.1133 |
| logSw: | -4.2694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.185 |
| InChI Key: | FGTAKBIVLVODTF-UHFFFAOYSA-N |