ethyl 4-{4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-{4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
ethyl 4-{4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
Compound characteristics
| Compound ID: | V012-3943 |
| Compound Name: | ethyl 4-{4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C24 H32 N4 O3 |
| Smiles: | CCc1c(C)nc(c2cccc(C)c2)nc1N1CCN(CC1)C(CCC(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6987 |
| logD: | 4.4945 |
| logSw: | -4.4072 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.86 |
| InChI Key: | PWMZDINGYSYXFP-UHFFFAOYSA-N |