N-[(furan-2-yl)methyl]-2-(4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)acetamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-(4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)acetamide
N-[(furan-2-yl)methyl]-2-(4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)acetamide
Compound characteristics
| Compound ID: | C241-1880 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-(4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)acetamide |
| Molecular Weight: | 516.53 |
| Molecular Formula: | C26 H20 N4 O6 S |
| Smiles: | C(C(NCc1ccco1)=O)c1ccc(cc1)N1C(c2c(ccs2)N(Cc2cccc(c2)[N+]([O-])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9054 |
| logD: | 3.9054 |
| logSw: | -4.1471 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.004 |
| InChI Key: | FQGPYRGSBCWCSK-UHFFFAOYSA-N |