2-[4-(3-chloro-2,2-dimethylpropanoyl)piperazin-1-yl]-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(3-chloro-2,2-dimethylpropanoyl)piperazin-1-yl]-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
2-[4-(3-chloro-2,2-dimethylpropanoyl)piperazin-1-yl]-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V023-8915 |
| Compound Name: | 2-[4-(3-chloro-2,2-dimethylpropanoyl)piperazin-1-yl]-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 491.01 |
| Molecular Formula: | C24 H32 Cl F N6 O2 |
| Smiles: | CC(C)(C[Cl])C(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccccc2F)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5068 |
| logD: | 1.3826 |
| logSw: | -2.8317 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.782 |
| InChI Key: | CFWLNPIYCMOVFU-UHFFFAOYSA-N |