N-[(furan-2-yl)methyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide
N-[(furan-2-yl)methyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | C241-1950 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide |
| Molecular Weight: | 516.53 |
| Molecular Formula: | C26 H20 N4 O6 S |
| Smiles: | C(c1ccco1)NC(c1ccc(CN2C(c3c(ccs3)N(Cc3cccc(c3)[N+]([O-])=O)C2=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7224 |
| logD: | 4.7224 |
| logSw: | -4.8111 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.829 |
| InChI Key: | USDRWTQVPUCBKG-UHFFFAOYSA-N |