2-(4-tert-butylphenyl)-4-{[2-(4-ethylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-{[2-(4-ethylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-tert-butylphenyl)-4-{[2-(4-ethylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1716 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-{[2-(4-ethylphenoxy)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 448.59 |
| Molecular Formula: | C25 H28 N4 O2 S |
| Smiles: | CCc1ccc(cc1)OCCSC1=NC(c2ccc(cc2)C(C)(C)C)=NC2=CC(NN12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0325 |
| logD: | 6.0325 |
| logSw: | -5.4466 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.351 |
| InChI Key: | IZNGBWPBKSRCNF-UHFFFAOYSA-N |