2,2,2-trichloroethyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2,2,2-trichloroethyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2,2,2-trichloroethyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 2191-2800 |
| Compound Name: | 2,2,2-trichloroethyl 4-(4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 381.62 |
| Molecular Formula: | C14 H12 Cl3 F N2 O3 |
| Smiles: | CC1=C(C(c2ccc(cc2)F)NC(N1)=O)C(=O)OCC([Cl])([Cl])[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6986 |
| logD: | 2.5483 |
| logSw: | -3.552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.821 |
| InChI Key: | NQMKFZLAWDWOCA-NSHDSACASA-N |