4-(3-bromo-4-fluorophenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Chemical Structure Depiction of
4-(3-bromo-4-fluorophenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
4-(3-bromo-4-fluorophenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Compound characteristics
| Compound ID: | K836-0054 |
| Compound Name: | 4-(3-bromo-4-fluorophenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one |
| Molecular Weight: | 447.35 |
| Molecular Formula: | C22 H24 Br F N2 O2 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccc(c(c1)[Br])F)C(N1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8123 |
| logD: | 0.696 |
| logSw: | -3.9793 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.569 |
| InChI Key: | NJHSJGNVNVCUSP-FQEVSTJZSA-N |