methyl 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | J026-3811 |
| Compound Name: | methyl 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 476.87 |
| Molecular Formula: | C21 H21 Cl N4 O7 |
| Smiles: | Cc1cc(C(=O)OC)c2C(N(CC(Nc3cc(c(cc3OC)OC)[Cl])=O)C(N(C)c2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5333 |
| logD: | 2.5299 |
| logSw: | -3.4448 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.896 |
| InChI Key: | FSVCGFRYBNTFAK-UHFFFAOYSA-N |