2-(3-chlorophenyl)-5-(2-hydroxyethyl)-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-5-(2-hydroxyethyl)-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one
2-(3-chlorophenyl)-5-(2-hydroxyethyl)-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | T604-0515 |
| Compound Name: | 2-(3-chlorophenyl)-5-(2-hydroxyethyl)-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 496.99 |
| Molecular Formula: | C26 H29 Cl N4 O4 |
| Smiles: | CC1=C(CCO)C(N(CC(N2CCN(CC2)c2ccccc2OC)=O)C(c2cccc(c2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2625 |
| logD: | 2.2616 |
| logSw: | -3.0353 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.639 |
| InChI Key: | LSHSLEVYWJKDAC-UHFFFAOYSA-N |