1-[2-(4-chloroanilino)-2-oxoethyl]-N-ethyl-2-(4-fluorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
Chemical Structure Depiction of
1-[2-(4-chloroanilino)-2-oxoethyl]-N-ethyl-2-(4-fluorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
1-[2-(4-chloroanilino)-2-oxoethyl]-N-ethyl-2-(4-fluorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | P491-4737 |
| Compound Name: | 1-[2-(4-chloroanilino)-2-oxoethyl]-N-ethyl-2-(4-fluorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide |
| Molecular Weight: | 428.85 |
| Molecular Formula: | C21 H18 Cl F N4 O3 |
| Smiles: | CCNC(C1=CN=C(c2ccc(cc2)F)N(CC(Nc2ccc(cc2)[Cl])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4863 |
| logD: | 2.4847 |
| logSw: | -3.4317 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.799 |
| InChI Key: | KQTCBLDLFWZFNB-UHFFFAOYSA-N |