2-(4-bromophenyl)-3,3,6-trimethyl-1,2,3,4-tetrahydroquinolin-4-yl acetate
Chemical Structure Depiction of
2-(4-bromophenyl)-3,3,6-trimethyl-1,2,3,4-tetrahydroquinolin-4-yl acetate
2-(4-bromophenyl)-3,3,6-trimethyl-1,2,3,4-tetrahydroquinolin-4-yl acetate
Compound characteristics
| Compound ID: | 3738-0359 |
| Compound Name: | 2-(4-bromophenyl)-3,3,6-trimethyl-1,2,3,4-tetrahydroquinolin-4-yl acetate |
| Molecular Weight: | 388.3 |
| Molecular Formula: | C20 H22 Br N O2 |
| Smiles: | CC(=O)OC1c2cc(C)ccc2NC(c2ccc(cc2)[Br])C1(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.676 |
| logD: | 5.676 |
| logSw: | -5.4569 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.186 |
| InChI Key: | BCEDLRVDXGOYOM-UHFFFAOYSA-N |