3,3-dimethyl-1-{2-methyl-4-[6-(2-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
3,3-dimethyl-1-{2-methyl-4-[6-(2-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl}butan-1-one
3,3-dimethyl-1-{2-methyl-4-[6-(2-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V027-5814 |
| Compound Name: | 3,3-dimethyl-1-{2-methyl-4-[6-(2-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C22 H30 N4 O2 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(CC(C)(C)C)=O)c1cc(ncn1)Oc1ccccc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4702 |
| logD: | 4.4702 |
| logSw: | -4.535 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.118 |
| InChI Key: | JTQLFSIKPZQEJR-KRWDZBQOSA-N |