methyl 2-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
Chemical Structure Depiction of
methyl 2-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
methyl 2-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
Compound characteristics
| Compound ID: | C200-2171 |
| Compound Name: | methyl 2-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate |
| Molecular Weight: | 433.38 |
| Molecular Formula: | C21 H15 N5 O6 |
| Smiles: | COC(c1cccnc1N1C(c2cccnc2N(Cc2ccc(cc2)[N+]([O-])=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5949 |
| logD: | 2.5949 |
| logSw: | -2.9943 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 104.522 |
| InChI Key: | SHTKHCYDPZSYQD-UHFFFAOYSA-N |