2-(3,4-dimethylphenyl)-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
2-(3,4-dimethylphenyl)-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D489-0164 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 387.91 |
| Molecular Formula: | C20 H25 N5 O |
| Salt: | HCl |
| Smiles: | CC1CCN(CC1)CC1=CC(n2c(N1)nc(c1ccc(C)c(C)c1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7631 |
| logD: | 2.831 |
| logSw: | -3.9065 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.073 |
| InChI Key: | VOHJQUATWPHFAA-UHFFFAOYSA-N |