3-[1-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-9-{[3-(trifluoromethyl)phenyl]methoxy}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[1-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-9-{[3-(trifluoromethyl)phenyl]methoxy}-4H-pyrido[1,2-a]pyrimidin-4-one
3-[1-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-9-{[3-(trifluoromethyl)phenyl]methoxy}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | V004-3634 |
| Compound Name: | 3-[1-(4-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-9-{[3-(trifluoromethyl)phenyl]methoxy}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 524.93 |
| Molecular Formula: | C27 H20 Cl F3 N4 O2 |
| Smiles: | CC1=C(C(N2C=CC=C(C2=N1)OCc1cccc(c1)C(F)(F)F)=O)c1cc(C)n(c2ccc(cc2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.5262 |
| logD: | 5.5229 |
| logSw: | -6.0829 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.868 |
| InChI Key: | IBTPBMPDHXHRBV-UHFFFAOYSA-N |