methyl 2-{[6-fluoro-3-(piperidine-1-carbonyl)quinolin-4-yl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[6-fluoro-3-(piperidine-1-carbonyl)quinolin-4-yl]amino}benzoate
methyl 2-{[6-fluoro-3-(piperidine-1-carbonyl)quinolin-4-yl]amino}benzoate
Compound characteristics
| Compound ID: | F080-1129 |
| Compound Name: | methyl 2-{[6-fluoro-3-(piperidine-1-carbonyl)quinolin-4-yl]amino}benzoate |
| Molecular Weight: | 407.44 |
| Molecular Formula: | C23 H22 F N3 O3 |
| Smiles: | COC(c1ccccc1Nc1c(cnc2ccc(cc12)F)C(N1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1766 |
| logD: | 4.1745 |
| logSw: | -4.0708 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.732 |
| InChI Key: | PWUBGEJEUXKLDY-UHFFFAOYSA-N |