2,2,2-trifluoroethyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2,2,2-trifluoroethyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2,2,2-trifluoroethyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8008-6865 |
| Compound Name: | 2,2,2-trifluoroethyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 359.26 |
| Molecular Formula: | C14 H12 F3 N3 O5 |
| Smiles: | CC1=C(C(c2ccc(cc2)[N+]([O-])=O)NC(N1)=O)C(=O)OCC(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8769 |
| logD: | 1.7267 |
| logSw: | -2.5153 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.202 |
| InChI Key: | UQEBYDDLNFUSJZ-NSHDSACASA-N |