[7-(1-ethyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](5-methylthiophen-2-yl)methanone
Chemical Structure Depiction of
[7-(1-ethyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](5-methylthiophen-2-yl)methanone
[7-(1-ethyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](5-methylthiophen-2-yl)methanone
Compound characteristics
Compound ID: | Y503-3425 |
Compound Name: | [7-(1-ethyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](5-methylthiophen-2-yl)methanone |
Molecular Weight: | 408.4 |
Molecular Formula: | C17 H15 F3 N6 O S |
Smiles: | CCn1cc(cn1)C1C(=C(C(F)(F)F)Nc2ncnn12)C(c1ccc(C)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1503 |
logD: | 1.1484 |
logSw: | -3.1663 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.478 |
InChI Key: | TXNIVZXGDPEKAM-ZDUSSCGKSA-N |