methyl 2-{1-[2-(3-fluoro-4-methylanilino)-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-(3-fluoro-4-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
methyl 2-{1-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate
Compound characteristics
| Compound ID: | C200-2053 |
| Compound Name: | methyl 2-{1-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl}pyridine-3-carboxylate |
| Molecular Weight: | 463.42 |
| Molecular Formula: | C23 H18 F N5 O5 |
| Smiles: | Cc1ccc(cc1F)NC(CN1C(N(C(c2cccnc12)=O)c1c(cccn1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7249 |
| logD: | 2.7248 |
| logSw: | -3.1386 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.29 |
| InChI Key: | ICVHNJXLPAOFMU-UHFFFAOYSA-N |