ethyl 3-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 3-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
ethyl 3-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
Compound ID: | J026-3975 |
Compound Name: | ethyl 3-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
Molecular Weight: | 498.84 |
Molecular Formula: | C21 H18 Cl F3 N4 O5 |
Smiles: | CCOC(c1cc(C)nc2c1C(N(CC(Nc1cc(ccc1[Cl])C(F)(F)F)=O)C(N2C)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0031 |
logD: | 3.9885 |
logSw: | -4.7013 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.215 |
InChI Key: | BIYBMMCGZAKEGT-UHFFFAOYSA-N |