N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0324 |
| Compound Name: | N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 558.58 |
| Molecular Formula: | C27 H25 F3 N4 O4 S |
| Smiles: | CCN(CC)C(c1c(C)c2C(N(C(N(CC(Nc3ccccc3C(F)(F)F)=O)c2s1)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0014 |
| logD: | 4.0014 |
| logSw: | -4.3265 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.491 |
| InChI Key: | JUCCBIGWNGGRQW-UHFFFAOYSA-N |