3-(octahydroquinolin-1(2H)-yl)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(octahydroquinolin-1(2H)-yl)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-(octahydroquinolin-1(2H)-yl)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E882-0559 |
| Compound Name: | 3-(octahydroquinolin-1(2H)-yl)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 337.46 |
| Molecular Formula: | C22 H27 N O2 |
| Smiles: | Cc1cc(C)c(cc1C)C1=C(C(C1=O)=O)N1CCCC2CCCCC12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7762 |
| logD: | 4.7762 |
| logSw: | -4.4401 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.3636 |
| InChI Key: | SRTKYLVWXTYSBV-UHFFFAOYSA-N |