2-(3-methylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(3-methylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
2-(3-methylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D351-0441 |
| Compound Name: | 2-(3-methylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 374.87 |
| Molecular Formula: | C18 H22 N6 O |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)c1nc2NC(CN3CCN(C)CC3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.564 |
| logD: | 0.616 |
| logSw: | -2.216 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.55 |
| InChI Key: | ZJPSLJLJKYYPBI-UHFFFAOYSA-N |