5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D489-0121 |
| Compound Name: | 5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C20 H19 F N6 O S |
| Salt: | HCl |
| Smiles: | C1CN(CCN1CC1=CC(n2c(N1)nc(c1cccs1)n2)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.883 |
| logD: | 2.5117 |
| logSw: | -3.2932 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.352 |
| InChI Key: | HIRVSLNSCXZBBX-UHFFFAOYSA-N |