9-methyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-7-(trifluoromethyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
9-methyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-7-(trifluoromethyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
9-methyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-7-(trifluoromethyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y500-7353 |
| Compound Name: | 9-methyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-7-(trifluoromethyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 477.36 |
| Molecular Formula: | C19 H10 F7 N3 O2 S |
| Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(C(NC(c3cccc(c3)OC(C(F)F)(F)F)=N1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.0549 |
| logD: | 5.0519 |
| logSw: | -4.9879 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.381 |
| InChI Key: | DWGGOXOIJRIJLE-UHFFFAOYSA-N |