methyl 2-({1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carbonyl}amino)benzoate
methyl 2-({1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | F070-0686 |
| Compound Name: | methyl 2-({1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carbonyl}amino)benzoate |
| Molecular Weight: | 458.44 |
| Molecular Formula: | C23 H21 F3 N4 O3 |
| Smiles: | COC(c1ccccc1NC(C1CCCN(C1)c1c(C(F)(F)F)nc2ccccc2n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2454 |
| logD: | 4.1402 |
| logSw: | -4.292 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.828 |
| InChI Key: | BJHZIRRXAYOQPF-AWEZNQCLSA-N |