4-[(2-ethoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[(2-ethoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(2-ethoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
Compound ID: | C200-7480 |
Compound Name: | 4-[(2-ethoxyphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
Molecular Weight: | 500.5 |
Molecular Formula: | C24 H19 F3 N4 O3 S |
Smiles: | CCOc1ccccc1CN1C2=NN(Cc3cccc(c3)C(F)(F)F)C(N2c2ccsc2C1=O)=O |
Stereo: | ACHIRAL |
logP: | 5.146 |
logD: | 5.146 |
logSw: | -5.0673 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 56.164 |
InChI Key: | CEGIATNPBSHQSG-UHFFFAOYSA-N |