2-(4-tert-butylphenyl)-4-{[3-(2-methoxyphenoxy)propyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-{[3-(2-methoxyphenoxy)propyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-tert-butylphenyl)-4-{[3-(2-methoxyphenoxy)propyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1705 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-{[3-(2-methoxyphenoxy)propyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 464.59 |
| Molecular Formula: | C25 H28 N4 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=NC2=CC(NN2C(=N1)SCCCOc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3576 |
| logD: | 5.3576 |
| logSw: | -5.2982 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.068 |
| InChI Key: | SPZPFUHOKVBSQH-UHFFFAOYSA-N |