4-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-(4-methoxyphenyl)butanamide
Chemical Structure Depiction of
4-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-(4-methoxyphenyl)butanamide
4-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-(4-methoxyphenyl)butanamide
Compound characteristics
| Compound ID: | C241-1181 |
| Compound Name: | 4-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-(4-methoxyphenyl)butanamide |
| Molecular Weight: | 560.55 |
| Molecular Formula: | C26 H23 F3 N4 O5 S |
| Smiles: | COc1ccc(cc1)NC(CCCN1C(c2c(ccs2)N(CC(Nc2cccc(c2)C(F)(F)F)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2884 |
| logD: | 4.2879 |
| logSw: | -4.2765 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.106 |
| InChI Key: | RATHAFUFEKISNM-UHFFFAOYSA-N |