methyl 7-cyclopropyl-3-[2-(2,4-difluoroanilino)-2-oxoethyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 7-cyclopropyl-3-[2-(2,4-difluoroanilino)-2-oxoethyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 7-cyclopropyl-3-[2-(2,4-difluoroanilino)-2-oxoethyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | J026-4009 |
| Compound Name: | methyl 7-cyclopropyl-3-[2-(2,4-difluoroanilino)-2-oxoethyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 444.39 |
| Molecular Formula: | C21 H18 F2 N4 O5 |
| Smiles: | CN1C(N(CC(Nc2ccc(cc2F)F)=O)C(c2c(cc(C3CC3)nc12)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9527 |
| logD: | 2.9489 |
| logSw: | -3.2737 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.08 |
| InChI Key: | WHZNHTYDGKWFKZ-UHFFFAOYSA-N |