(5-chlorothiophen-2-yl)[7-(4-methoxyphenyl)-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-methoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
(5-chlorothiophen-2-yl)[7-(4-methoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
Compound characteristics
| Compound ID: | Y502-7771 |
| Compound Name: | (5-chlorothiophen-2-yl)[7-(4-methoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone |
| Molecular Weight: | 440.83 |
| Molecular Formula: | C18 H12 Cl F3 N4 O2 S |
| Smiles: | COc1ccc(cc1)C1C(=C(C(F)(F)F)Nc2ncnn12)C(c1ccc(s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6718 |
| logD: | 2.5911 |
| logSw: | -5.0676 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.52 |
| InChI Key: | DYPRSOJQROVDMO-AWEZNQCLSA-N |