8-Quinolyl 2,4,6-trimethylbenzenesulfonate
TL;DR: 8-Quinolyl 2,4,6-trimethylbenzenesulfonate (CAS 352444-41-8) is a chemical compound with molecular formula C18H17NO3S and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
quinolin-8-yl 2,4,6-trimethylbenzenesulfonate
Also Known As: 8-quinolyl 2,4,6-trimethylbenzenesulfonate, BAS 00667969, quinolin-8-yl 2,4,6-trimethylbenzenesulfonate, 8-quinolinyl 2,4,6-trimethylbenzenesulfonate, 2,4,6-Trimethyl-benzenesulfonic acid quinolin-8-yl ester
| Molecular Formula | C18H17NO3S |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 3.92776 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.09293 |
| Heavy Atoms | 23 |
| Complexity | 965.8194 |
Chemical Identifiers
| CAS Number | 352444-41-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=CC=CC3=C2N=CC=C3)C |
Product Overview
8-Quinolyl 2,4,6-trimethylbenzenesulfonate (CAS 352444-41-8), with molecular formula C18H17NO3S and molecular weight 327.09 g/mol. IUPAC: quinolin-8-yl 2,4,6-trimethylbenzenesulfonate.
Chemical Property Profile of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate
Property Insights of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate
The XLogP value of 3.92776 indicates that 8-Quinolyl 2,4,6-trimethylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, 8-Quinolyl 2,4,6-trimethylbenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Quinolyl 2,4,6-trimethylbenzenesulfonate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate?
The CAS number of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate is 352444-41-8.
What is the molecular formula of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate?
The molecular formula of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate is C18H17NO3S.
What is the molecular weight of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate?
The molecular weight of 8-Quinolyl 2,4,6-trimethylbenzenesulfonate is 327.09 g/mol.
Where can I buy 8-Quinolyl 2,4,6-trimethylbenzenesulfonate?
You can request a quote for 8-Quinolyl 2,4,6-trimethylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Quinolyl 2,4,6-trimethylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 8-Quinolyl 2,4,6-trimethylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.