ethyl 4-[4-(4-chloro-3-nitrobenzamido)phenyl]-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(4-chloro-3-nitrobenzamido)phenyl]-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-[4-(4-chloro-3-nitrobenzamido)phenyl]-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V012-5503 |
| Compound Name: | ethyl 4-[4-(4-chloro-3-nitrobenzamido)phenyl]-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 500.94 |
| Molecular Formula: | C24 H25 Cl N4 O6 |
| Smiles: | CCCN1C(C)=C(C(c2ccc(cc2)NC(c2ccc(c(c2)[N+]([O-])=O)[Cl])=O)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1072 |
| logD: | 4.1014 |
| logSw: | -4.6657 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.813 |
| InChI Key: | XEKGRKBWQXRION-NRFANRHFSA-N |