3-{[6,8-dichloro-3-(ethoxycarbonyl)quinolin-4-yl]amino}-4-methylbenzoic acid
Chemical Structure Depiction of
3-{[6,8-dichloro-3-(ethoxycarbonyl)quinolin-4-yl]amino}-4-methylbenzoic acid
3-{[6,8-dichloro-3-(ethoxycarbonyl)quinolin-4-yl]amino}-4-methylbenzoic acid
Compound characteristics
| Compound ID: | 4789-4422 |
| Compound Name: | 3-{[6,8-dichloro-3-(ethoxycarbonyl)quinolin-4-yl]amino}-4-methylbenzoic acid |
| Molecular Weight: | 419.26 |
| Molecular Formula: | C20 H16 Cl2 N2 O4 |
| Smiles: | CCOC(c1cnc2c(cc(cc2c1Nc1cc(ccc1C)C(O)=O)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6751 |
| logD: | 2.7993 |
| logSw: | -5.616 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.842 |
| InChI Key: | KKZZONKTTJESIO-UHFFFAOYSA-N |