4-(3-ethoxypropyl)-5-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(3-ethoxypropyl)-5-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-4H-1,2,4-triazole-3-thiol
4-(3-ethoxypropyl)-5-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-6143 |
| Compound Name: | 4-(3-ethoxypropyl)-5-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 494.58 |
| Molecular Formula: | C23 H29 F3 N6 O S |
| Smiles: | CCOCCCn1c(c2cc3NC(CC(C(F)(F)F)n3n2)c2ccc(cc2)C(C)C)nnc1S |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.0549 |
| logD: | 4.9607 |
| logSw: | -4.6045 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.47 |
| InChI Key: | TZCFNHGMEUXFFM-UHFFFAOYSA-N |