5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate
TL;DR: 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate (CAS 10522-49-3) is a chemical compound with molecular formula C16H11Br2NO3S and molecular weight 454.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5,7-dibromoquinolin-8-yl) 4-methylbenzenesulfonate
Also Known As: BAS 00463600, 5,7-dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate, 5,7-dibromoquinolin-8-yl 4-methylbenzenesulfonate, (5,7-dibromoquinolin-8-yl) 4-methylbenzenesulfonate, 5,7-dibromo-8-quinolyl 4-methylbenzenesulfonate
| Molecular Formula | C16H11Br2NO3S |
|---|---|
| Molecular Weight | 454.88 g/mol |
| LogP | 4.83592 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 454.88263 |
| Heavy Atoms | 23 |
| Complexity | 986.12805 |
Chemical Identifiers
| CAS Number | 10522-49-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br |
Product Overview
5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate (CAS 10522-49-3), with molecular formula C16H11Br2NO3S and molecular weight 454.88 g/mol. IUPAC: (5,7-dibromoquinolin-8-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate
Property Insights of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate
The XLogP value of 4.83592 indicates that 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate 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 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate?
The CAS number of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate is 10522-49-3.
What is the molecular formula of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate?
The molecular formula of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate is C16H11Br2NO3S.
What is the molecular weight of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate?
The molecular weight of 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate is 454.88 g/mol.
Where can I buy 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate?
You can request a quote for 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dibromoquinolin-8-yl 4-methylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.