3-[(2-fluorophenyl)methyl]-5-methyl-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-[(2-fluorophenyl)methyl]-5-methyl-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-[(2-fluorophenyl)methyl]-5-methyl-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K821-0364 |
| Compound Name: | 3-[(2-fluorophenyl)methyl]-5-methyl-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 676.75 |
| Molecular Formula: | C36 H25 F N4 O5 S2 |
| Smiles: | Cc1c2C(N(Cc3ccccc3F)C=Nc2sc1C(Nc1ccc(cc1)Oc1ccc2C(N(C(c2c1)=O)c1ccccc1SC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6451 |
| logD: | 6.6439 |
| logSw: | -5.7747 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.421 |
| InChI Key: | JDXSIWFEMMQYQH-UHFFFAOYSA-N |