3-{3,5-dimethyl-1-[6-(piperidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one
Chemical Structure Depiction of
3-{3,5-dimethyl-1-[6-(piperidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one
3-{3,5-dimethyl-1-[6-(piperidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | F644-0346 |
| Compound Name: | 3-{3,5-dimethyl-1-[6-(piperidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C27 H34 F N7 O |
| Smiles: | Cc1c(CCC(N2CCN(CC2)c2ccccc2F)=O)c(C)n(c2cc(ncn2)N2CCCCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3938 |
| logD: | 4.3599 |
| logSw: | -4.3719 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.926 |
| InChI Key: | YOMVKBVHLMKFRU-UHFFFAOYSA-N |