(5-chlorothiophen-2-yl)[7-(4-ethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
Chemical Structure Depiction of
(5-chlorothiophen-2-yl)[7-(4-ethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
(5-chlorothiophen-2-yl)[7-(4-ethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
Compound characteristics
| Compound ID: | Y500-7297 |
| Compound Name: | (5-chlorothiophen-2-yl)[7-(4-ethoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone |
| Molecular Weight: | 454.86 |
| Molecular Formula: | C19 H14 Cl F3 N4 O2 S |
| Smiles: | CCOc1ccc(cc1)C1C(=C(C(F)(F)F)Nc2ncnn12)C(c1ccc(s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0584 |
| logD: | 2.9777 |
| logSw: | -5.2695 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.1 |
| InChI Key: | OCICQYJUXQDFSX-HNNXBMFYSA-N |