3,3-dimethyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
3,3-dimethyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one
3,3-dimethyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | G868-0198 |
| Compound Name: | 3,3-dimethyl-1-{4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C22 H31 N5 O |
| Smiles: | Cc1ccc(cc1)Nc1cc(C)nc(n1)N1CCN(CC1)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0118 |
| logD: | 4.4365 |
| logSw: | -4.6573 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.675 |
| InChI Key: | XVGIPVPCRHMSRR-UHFFFAOYSA-N |