2-{[(4-fluorophenyl)methyl]amino}-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]amino}-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-fluorophenyl)methyl]amino}-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0255 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]amino}-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C23 H23 F2 N7 O |
| Smiles: | C(c1ccc(cc1)F)Nc1nc2NC(CN3CCN(CC3)c3ccc(cc3)F)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6091 |
| logD: | 2.2434 |
| logSw: | -2.9831 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.974 |
| InChI Key: | BXCKAJVQVOELHA-UHFFFAOYSA-N |