2-(4-methylphenyl)-4-[(3-phenoxypropyl)sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(4-methylphenyl)-4-[(3-phenoxypropyl)sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-methylphenyl)-4-[(3-phenoxypropyl)sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-0425 |
| Compound Name: | 2-(4-methylphenyl)-4-[(3-phenoxypropyl)sulfanyl]pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C21 H20 N4 O2 S |
| Smiles: | Cc1ccc(cc1)C1=NC2=CC(NN2C(=N1)SCCCOc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2748 |
| logD: | 4.2748 |
| logSw: | -4.2179 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.351 |
| InChI Key: | BIQKTZVSLSPLMF-UHFFFAOYSA-N |