N-[(2-chlorophenyl)methyl]-2-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}acetamide
N-[(2-chlorophenyl)methyl]-2-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}acetamide
Compound characteristics
| Compound ID: | C241-1855 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}acetamide |
| Molecular Weight: | 484.92 |
| Molecular Formula: | C22 H17 Cl N4 O5 S |
| Smiles: | C(c1ccccc1[Cl])NC(CN1C(c2c(ccs2)N(Cc2cccc(c2)[N+]([O-])=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2405 |
| logD: | 4.2405 |
| logSw: | -4.4554 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.138 |
| InChI Key: | AKCANVMDBVLIQH-UHFFFAOYSA-N |