1-[4-(4-anilino-6-methylpyrimidin-2-yl)piperazin-1-yl]-4-phenylbutan-1-one
Chemical Structure Depiction of
1-[4-(4-anilino-6-methylpyrimidin-2-yl)piperazin-1-yl]-4-phenylbutan-1-one
1-[4-(4-anilino-6-methylpyrimidin-2-yl)piperazin-1-yl]-4-phenylbutan-1-one
Compound characteristics
| Compound ID: | G868-0163 |
| Compound Name: | 1-[4-(4-anilino-6-methylpyrimidin-2-yl)piperazin-1-yl]-4-phenylbutan-1-one |
| Molecular Weight: | 415.54 |
| Molecular Formula: | C25 H29 N5 O |
| Smiles: | Cc1cc(Nc2ccccc2)nc(n1)N1CCN(CC1)C(CCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0891 |
| logD: | 4.5137 |
| logSw: | -4.9559 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.404 |
| InChI Key: | VQAANPVTCRKHDG-UHFFFAOYSA-N |