ethyl 1-butyl-4-[3-(4-methyl-3-nitrobenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-butyl-4-[3-(4-methyl-3-nitrobenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-butyl-4-[3-(4-methyl-3-nitrobenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V010-6772 |
| Compound Name: | ethyl 1-butyl-4-[3-(4-methyl-3-nitrobenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 556.62 |
| Molecular Formula: | C31 H32 N4 O6 |
| Smiles: | CCCCN1C(=C(C(c2cccc(c2)NC(c2ccc(C)c(c2)[N+]([O-])=O)=O)NC1=O)C(=O)OCC)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5892 |
| logD: | 6.5866 |
| logSw: | -5.5958 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.951 |
| InChI Key: | KJFQGAXVSDGVJG-MHZLTWQESA-N |