5-{[benzyl(methyl)amino]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-{[benzyl(methyl)amino]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-{[benzyl(methyl)amino]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0444 |
| Compound Name: | 5-{[benzyl(methyl)amino]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 359.43 |
| Molecular Formula: | C21 H21 N5 O |
| Smiles: | Cc1cccc(c1)c1nc2NC(CN(C)Cc3ccccc3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4636 |
| logD: | 2.532 |
| logSw: | -3.7692 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.185 |
| InChI Key: | AFSWWTFESGKHQF-UHFFFAOYSA-N |