2-(ethylsulfanyl)-7-[2-(trifluoromethyl)phenyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
2-(ethylsulfanyl)-7-[2-(trifluoromethyl)phenyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
2-(ethylsulfanyl)-7-[2-(trifluoromethyl)phenyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-8445 |
| Compound Name: | 2-(ethylsulfanyl)-7-[2-(trifluoromethyl)phenyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 391.37 |
| Molecular Formula: | C17 H12 F3 N5 O S |
| Smiles: | CCSc1nc2N=CC3=C(C=CN(C3=O)c3ccccc3C(F)(F)F)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.298 |
| logD: | 3.298 |
| logSw: | -3.8146 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.784 |
| InChI Key: | MCIJZMBOHPBTPS-UHFFFAOYSA-N |