2-[4-(4-chlorophenyl)-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl]-N-(3-cyanophenyl)acetamide
Chemical Structure Depiction of
2-[4-(4-chlorophenyl)-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl]-N-(3-cyanophenyl)acetamide
2-[4-(4-chlorophenyl)-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl]-N-(3-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | S350-0104 |
| Compound Name: | 2-[4-(4-chlorophenyl)-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl]-N-(3-cyanophenyl)acetamide |
| Molecular Weight: | 422.83 |
| Molecular Formula: | C21 H15 Cl N4 O4 |
| Smiles: | C(C(Nc1cccc(C#N)c1)=O)N1C2COC(C=2C(c2ccc(cc2)[Cl])NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7546 |
| logD: | 2.7519 |
| logSw: | -3.6899 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.597 |
| InChI Key: | XLKLATJGQLGQDZ-LJQANCHMSA-N |