N-[(furan-2-yl)methyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
N-[(furan-2-yl)methyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Compound characteristics
Compound ID: | C241-1518 |
Compound Name: | N-[(furan-2-yl)methyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide |
Molecular Weight: | 454.46 |
Molecular Formula: | C21 H18 N4 O6 S |
Smiles: | C(CN1C(c2c(ccs2)N(Cc2ccc(cc2)[N+]([O-])=O)C1=O)=O)C(NCc1ccco1)=O |
Stereo: | ACHIRAL |
logP: | 3.4866 |
logD: | 3.4866 |
logSw: | -3.7308 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 97.865 |
InChI Key: | YEDNXYJGMASXIE-UHFFFAOYSA-N |