ethyl 1-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
ethyl 1-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | K892-0218 |
| Compound Name: | ethyl 1-(5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate |
| Molecular Weight: | 550.56 |
| Molecular Formula: | C25 H25 F3 N4 O5 S |
| Smiles: | CCOC(C1CCCN(C1)C(c1c(C)c2C(N(CC(Nc3cccc(c3)C(F)(F)F)=O)C=Nc2s1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5786 |
| logD: | 3.5783 |
| logSw: | -3.9624 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.726 |
| InChI Key: | FQCYUFJSUGJABS-HNNXBMFYSA-N |