6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-{4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-{4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidin-4(3H)-one
6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-{4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6382 |
| Compound Name: | 6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-{4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidin-4(3H)-one |
| Molecular Weight: | 544.55 |
| Molecular Formula: | C27 H28 F4 N6 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(NC(=N1)N1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 2.9951 |
| logD: | 1.8709 |
| logSw: | -3.3486 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.511 |
| InChI Key: | MTCQKKOQIXDRTH-UHFFFAOYSA-N |