2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C241-1890 |
| Compound Name: | 2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 496.54 |
| Molecular Formula: | C27 H20 N4 O4 S |
| Smiles: | C(C(NCc1ccco1)=O)c1ccc(cc1)N1C(c2c(ccs2)N(Cc2ccccc2C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7085 |
| logD: | 3.7085 |
| logSw: | -4.1539 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.679 |
| InChI Key: | HYQBAMMYEMQLLM-UHFFFAOYSA-N |