2-{[(4-methylphenyl)methyl]amino}-5-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-methylphenyl)methyl]amino}-5-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-methylphenyl)methyl]amino}-5-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0115 |
| Compound Name: | 2-{[(4-methylphenyl)methyl]amino}-5-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C24 H27 N7 O |
| Smiles: | Cc1ccc(CNc2nc3NC(CN4CCN(CC4)c4ccccc4)=CC(n3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8528 |
| logD: | 2.4871 |
| logSw: | -3.1637 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.974 |
| InChI Key: | NHLYPJVRBHCDBV-UHFFFAOYSA-N |