2,2,2-trifluoroethyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2,2,2-trifluoroethyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2,2,2-trifluoroethyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 2525-3981 |
| Compound Name: | 2,2,2-trifluoroethyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 393.16 |
| Molecular Formula: | C14 H12 Br F3 N2 O3 |
| Smiles: | CC1=C(C(c2ccc(cc2)[Br])NC(N1)=O)C(=O)OCC(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7852 |
| logD: | 2.6349 |
| logSw: | -3.1362 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.821 |
| InChI Key: | AADYWSDVQPGWFA-NSHDSACASA-N |