ethyl N-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)glycinate
Chemical Structure Depiction of
ethyl N-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)glycinate
ethyl N-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)glycinate
Compound characteristics
| Compound ID: | K892-0203 |
| Compound Name: | ethyl N-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)glycinate |
| Molecular Weight: | 496.46 |
| Molecular Formula: | C21 H19 F3 N4 O5 S |
| Smiles: | CCOC(CNC(c1c(C)c2C(N(CC(Nc3cccc(c3)C(F)(F)F)=O)C=Nc2s1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8644 |
| logD: | 2.8641 |
| logSw: | -3.3034 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.234 |
| InChI Key: | GRTCJOKQXWJVCO-UHFFFAOYSA-N |