4-{[(3-bromophenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
4-{[(3-bromophenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
4-{[(3-bromophenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1971 |
| Compound Name: | 4-{[(3-bromophenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 419.32 |
| Molecular Formula: | C16 H11 Br N4 O S2 |
| Smiles: | C(c1cccc(c1)[Br])SC1=NC(c2cccs2)=NC2=CC(NN12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8732 |
| logD: | 3.8732 |
| logSw: | -4.0313 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.951 |
| InChI Key: | AOYJAJKMCWQPLG-UHFFFAOYSA-N |