2-phenyl-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Chemical Structure Depiction of
2-phenyl-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
2-phenyl-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Compound characteristics
| Compound ID: | G649-0006 |
| Compound Name: | 2-phenyl-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C21 H20 N6 O2 S |
| Smiles: | C1CN(CCN1CC1=CC(N2C(NC(c3ccccc3)=N2)=N1)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.651 |
| logD: | 1.651 |
| logSw: | -2.4566 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.403 |
| InChI Key: | RGAONKXHEKQQIW-UHFFFAOYSA-N |