methyl 2-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
Chemical Structure Depiction of
methyl 2-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
methyl 2-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
Compound characteristics
| Compound ID: | C200-2047 |
| Compound Name: | methyl 2-{1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate |
| Molecular Weight: | 495.88 |
| Molecular Formula: | C23 H18 Cl N5 O6 |
| Smiles: | COC(c1cccnc1N1C(c2cccnc2N(CC(Nc2cc(ccc2OC)[Cl])=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.328 |
| logD: | 2.3258 |
| logSw: | -3.4405 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.223 |
| InChI Key: | UEEHJCYSTGCWPN-UHFFFAOYSA-N |