5-{[benzyl(methyl)amino]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-{[benzyl(methyl)amino]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
5-{[benzyl(methyl)amino]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D351-0014 |
| Compound Name: | 5-{[benzyl(methyl)amino]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 381.86 |
| Molecular Formula: | C20 H19 N5 O |
| Salt: | HCl |
| Smiles: | CN(CC1=CC(n2c(N1)nc(c1ccccc1)n2)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9892 |
| logD: | 2.0576 |
| logSw: | -3.3916 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.185 |
| InChI Key: | FMFNLNJTTZPRDS-UHFFFAOYSA-N |