N-benzyl-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-benzyl-2-(4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)acetamide
N-benzyl-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: | C241-1918 |
| Compound Name: | N-benzyl-2-(4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)acetamide |
| Molecular Weight: | 526.57 |
| Molecular Formula: | C28 H22 N4 O5 S |
| Smiles: | C(C(NCc1ccccc1)=O)c1ccc(cc1)N1C(c2c(ccs2)N(Cc2cccc(c2)[N+]([O-])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1548 |
| logD: | 4.1548 |
| logSw: | -4.3861 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.255 |
| InChI Key: | UQGWTLJAIXOVRH-UHFFFAOYSA-N |