1-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
1-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazin-1-yl}butan-1-one
1-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | D430-0219 |
| Compound Name: | 1-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 353.47 |
| Molecular Formula: | C20 H27 N5 O |
| Smiles: | CCCC(N1CCN(CC1)c1cc(Nc2ccc(C)cc2)nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1392 |
| logD: | 3.6231 |
| logSw: | -3.9919 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.018 |
| InChI Key: | TXRWUWFDRFTPSB-UHFFFAOYSA-N |