4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Chemical Structure Depiction of
4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Compound characteristics
| Compound ID: | K836-0119 |
| Compound Name: | 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-methyl-3-(piperidine-1-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one |
| Molecular Weight: | 430.93 |
| Molecular Formula: | C23 H27 Cl N2 O4 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1cc(c(c(c1)[Cl])O)OC)C(N1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5456 |
| logD: | 0.4293 |
| logSw: | -3.7389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.679 |
| InChI Key: | JPNBZXVZTISHHK-FQEVSTJZSA-N |