3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Chemical Structure Depiction of
3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Compound characteristics
| Compound ID: | G663-0141 |
| Compound Name: | 3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one |
| Molecular Weight: | 471.48 |
| Molecular Formula: | C24 H24 F3 N5 O2 |
| Smiles: | C1CCc2c(C1)cc1C(N(CC(N3CCN(CC3)c3cccc(c3)C(F)(F)F)=O)C=Nc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2686 |
| logD: | 3.2673 |
| logSw: | -3.4014 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.605 |
| InChI Key: | KWXUZDHGSSSLQF-UHFFFAOYSA-N |