4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V021-6426 |
| Compound Name: | 4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 559.57 |
| Molecular Formula: | C27 H29 F4 N7 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(NC(=N1)N1CCN(CC1)C(Nc1cccc(c1)C(F)(F)F)=O)=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.526 |
| logD: | 2.4018 |
| logSw: | -3.7895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.332 |
| InChI Key: | CDTLTKPEMIKFMF-UHFFFAOYSA-N |