5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0449 |
| Compound Name: | 5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 404.9 |
| Molecular Formula: | C19 H24 N6 O2 |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)c1nc2NC(CN3CCN(CC3)CCO)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1057 |
| logD: | 0.7425 |
| logSw: | -2.0737 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.519 |
| InChI Key: | DZVNXDIURIRSKD-UHFFFAOYSA-N |