3-methyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one
3-methyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | G868-0197 |
| Compound Name: | 3-methyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C21 H29 N5 O |
| Smiles: | CC(C)CC(N1CCN(CC1)c1nc(C)cc(Nc2ccc(C)cc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4962 |
| logD: | 3.9208 |
| logSw: | -4.1581 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.675 |
| InChI Key: | LTGRYZIRSKKAPT-UHFFFAOYSA-N |