2-(4-tert-butylphenyl)-4-{[2-(4-chloro-2-methylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-{[2-(4-chloro-2-methylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-tert-butylphenyl)-4-{[2-(4-chloro-2-methylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1700 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-{[2-(4-chloro-2-methylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 469 |
| Molecular Formula: | C24 H25 Cl N4 O2 S |
| Smiles: | Cc1cc(ccc1OCCSC1=NC(c2ccc(cc2)C(C)(C)C)=NC2=CC(NN12)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.5407 |
| logD: | 6.5407 |
| logSw: | -6.32 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.437 |
| InChI Key: | SFHJZOCDYXJPPL-UHFFFAOYSA-N |