7-chloro-2-{[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-chloro-2-{[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
7-chloro-2-{[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | T604-0244 |
| Compound Name: | 7-chloro-2-{[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 440.86 |
| Molecular Formula: | C22 H18 Cl F N4 O3 |
| Smiles: | CC1=C(CCO)C(N(CC2=CC(N3C=C(C=CC3=N2)[Cl])=O)C(c2ccc(cc2)F)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1482 |
| logD: | 1.1482 |
| logSw: | -2.5718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.162 |
| InChI Key: | SISHKEGJZYEPLB-UHFFFAOYSA-N |