5-[(4-methylpiperazin-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-[(4-methylpiperazin-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
5-[(4-methylpiperazin-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D351-0011 |
| Compound Name: | 5-[(4-methylpiperazin-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 360.84 |
| Molecular Formula: | C17 H20 N6 O |
| Salt: | HCl |
| Smiles: | CN1CCN(CC1)CC1=CC(n2c(N1)nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0897 |
| logD: | 0.1416 |
| logSw: | -2.1463 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.55 |
| InChI Key: | GRMQLOMBTVYQJO-UHFFFAOYSA-N |