3-phenyl-1-[2,2,4-trimethyl-4-(4-nitrophenyl)-3,4-dihydroquinolin-1(2H)-yl]prop-2-en-1-one
Chemical Structure Depiction of
3-phenyl-1-[2,2,4-trimethyl-4-(4-nitrophenyl)-3,4-dihydroquinolin-1(2H)-yl]prop-2-en-1-one
3-phenyl-1-[2,2,4-trimethyl-4-(4-nitrophenyl)-3,4-dihydroquinolin-1(2H)-yl]prop-2-en-1-one
Compound characteristics
| Compound ID: | Y020-5079 |
| Compound Name: | 3-phenyl-1-[2,2,4-trimethyl-4-(4-nitrophenyl)-3,4-dihydroquinolin-1(2H)-yl]prop-2-en-1-one |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C27 H26 N2 O3 |
| Smiles: | CC1(CC(C)(C)N(C(/C=C/c2ccccc2)=O)c2ccccc12)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0334 |
| logD: | 6.0314 |
| logSw: | -5.6201 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.907 |
| InChI Key: | ZQKJOJZPXTVIKE-MHZLTWQESA-N |