2-{[(4-methylphenyl)methyl]amino}-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-{[(4-methylphenyl)methyl]amino}-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
2-{[(4-methylphenyl)methyl]amino}-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: | D412-0109 |
| Compound Name: | 2-{[(4-methylphenyl)methyl]amino}-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 402.93 |
| Molecular Formula: | C20 H26 N6 O |
| Salt: | HCl |
| Smiles: | CC1CCN(CC1)CC1=CC(n2c(N1)nc(NCc1ccc(C)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6198 |
| logD: | 2.6198 |
| logSw: | -2.9612 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.713 |
| InChI Key: | MHMXCYBUUCBNPU-UHFFFAOYSA-N |