4-[(3-phenoxypropyl)sulfanyl]-2-phenylpyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
4-[(3-phenoxypropyl)sulfanyl]-2-phenylpyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
4-[(3-phenoxypropyl)sulfanyl]-2-phenylpyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-0077 |
| Compound Name: | 4-[(3-phenoxypropyl)sulfanyl]-2-phenylpyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | C(COc1ccccc1)CSC1=NC(c2ccccc2)=NC2=CC(NN12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7463 |
| logD: | 3.7463 |
| logSw: | -3.9899 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.351 |
| InChI Key: | KWZDYYUYDKOIAH-UHFFFAOYSA-N |