8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol
TL;DR: 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol (CAS 154325-32-3) is a chemical compound with molecular formula C16H21NO2S and molecular weight 291.1293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aR,8S)-8-[(S)-(4-methylphenyl)sulfinyl]-3,4,5,6,7,8-hexahydro-2H-quinolin-4a-ol
Also Known As: 8-TS-Octahydro-4a-quinolinol, 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol, (4aR,8R,SR)-8-(p-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a quinolinol, (4aR,8S)-8-[(S)-(4-methylphenyl)sulfinyl]-3,4,5,6,7,8-hexahydro-2H-quinolin-4a-ol, (4aR,8S)-8-[(S)-4-Methylbenzene-1-sulfinyl]-3,4,5,6,7,8-hexahydroquinolin-4a(2H)-ol
Technical Specifications
| Molecular Formula | C16H21NO2S |
| Molecular Weight | 291.1293 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 68.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.1293 Da |
| Heavy Atoms | 20 |
| Complexity | 415.0 |
| SMILES | CC1=CC=C(C=C1)[S@@](=O)[C@H]2CCC[C@@]3(C2=NCCC3)O |
| InChIKey | UGSRDPGGJRFDGW-YYFZDKIDSA-N |
Chemical Property Profile of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol
Property Insights of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol. Following Lipinski's Rule of Five, 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol?
The CAS number of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol is 154325-32-3.
What is the molecular formula of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol?
The molecular formula of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol is C16H21NO2S.
What is the molecular weight of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol?
The molecular weight of 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol is 291.1293 g/mol.
Where can I buy 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol?
You can request a quote for 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol?
Yes, CoreyChem provides custom synthesis services for 8-(4-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.