2-{2-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-oxoethyl}-4-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{2-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-oxoethyl}-4-nitro-1H-isoindole-1,3(2H)-dione
2-{2-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-oxoethyl}-4-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3535-0350 |
| Compound Name: | 2-{2-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-oxoethyl}-4-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 517.97 |
| Molecular Formula: | C28 H24 Cl N3 O5 |
| Smiles: | CC1(CC(C)(C)N(C(CN2C(c3cccc(c3C2=O)[N+]([O-])=O)=O)=O)c2ccccc12)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2701 |
| logD: | 4.2701 |
| logSw: | -4.9823 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.13 |
| InChI Key: | SDKSADDGBSIUPT-NDEPHWFRSA-N |