5-methyl-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
5-methyl-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
5-methyl-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K847-0777 |
| Compound Name: | 5-methyl-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 464.46 |
| Molecular Formula: | C21 H19 F3 N4 O3 S |
| Smiles: | Cc1c2C(N(CC(N3CCCC3)=O)C=Nc2sc1C(Nc1ccc(cc1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8061 |
| logD: | 2.805 |
| logSw: | -3.3857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.091 |
| InChI Key: | GMQUOUZKXCMJDI-UHFFFAOYSA-N |