ethyl 3-[(furan-2-yl)methyl]-5-methyl-4-oxo-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-[(furan-2-yl)methyl]-5-methyl-4-oxo-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-[(furan-2-yl)methyl]-5-methyl-4-oxo-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-0030 |
| Compound Name: | ethyl 3-[(furan-2-yl)methyl]-5-methyl-4-oxo-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 524.54 |
| Molecular Formula: | C23 H19 F3 N2 O5 S2 |
| Smiles: | CCOC(c1c(C)c2C(N(Cc3ccco3)C(=Nc2s1)SCc1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.733 |
| logD: | 5.733 |
| logSw: | -5.4862 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.112 |
| InChI Key: | LQLZCZHZFFKCDE-UHFFFAOYSA-N |