5-benzyl-2-({2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
5-benzyl-2-({2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-6-methylpyrimidin-4(3H)-one
5-benzyl-2-({2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D058-0151 |
| Compound Name: | 5-benzyl-2-({2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 464.59 |
| Molecular Formula: | C25 H28 N4 O3 S |
| Smiles: | CC1=C(Cc2ccccc2)C(NC(=N1)SCC(N1CCN(CC1)c1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0254 |
| logD: | 2.9409 |
| logSw: | -3.4649 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.863 |
| InChI Key: | HCFXNZCURFIPRV-UHFFFAOYSA-N |