ethyl 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate
ethyl 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate
Compound characteristics
| Compound ID: | L392-1492 |
| Compound Name: | ethyl 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(3H)-carboxylate |
| Molecular Weight: | 498.94 |
| Molecular Formula: | C25 H24 Cl F N4 O4 |
| Smiles: | CCOC(N1CCC2=C(C1)N=C(c1ccc(cc1)F)N(CC(Nc1ccc(C)c(c1)[Cl])=O)C2=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4475 |
| logD: | 4.4472 |
| logSw: | -4.5453 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.184 |
| InChI Key: | RNEFYJLKUIXJGU-UHFFFAOYSA-N |