5-{[4-(3-methylbenzoyl)piperazin-1-yl]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Chemical Structure Depiction of
5-{[4-(3-methylbenzoyl)piperazin-1-yl]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
5-{[4-(3-methylbenzoyl)piperazin-1-yl]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Compound characteristics
| Compound ID: | G649-0024 |
| Compound Name: | 5-{[4-(3-methylbenzoyl)piperazin-1-yl]methyl}-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C24 H24 N6 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCN(CC1)CC1=CC(N2C(NC(c3ccccc3)=N2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8016 |
| logD: | 1.8016 |
| logSw: | -2.5021 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.385 |
| InChI Key: | WMADNMNTUMGKEN-UHFFFAOYSA-N |