2-(4-chlorophenyl)-3-[(3-fluoro-4-methoxyphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-3-[(3-fluoro-4-methoxyphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
2-(4-chlorophenyl)-3-[(3-fluoro-4-methoxyphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | T604-0479 |
| Compound Name: | 2-(4-chlorophenyl)-3-[(3-fluoro-4-methoxyphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 402.85 |
| Molecular Formula: | C21 H20 Cl F N2 O3 |
| Smiles: | CC1=C(CCO)C(N(Cc2ccc(c(c2)F)OC)C(c2ccc(cc2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2096 |
| logD: | 3.2095 |
| logSw: | -3.5613 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.287 |
| InChI Key: | QSBQCZLVVYAUEM-UHFFFAOYSA-N |