8-喹啉磺酸3,4-二氯苯酯
TL;DR: 8-喹啉磺酸3,4-二氯苯酯 (CAS 158729-19-2) is a chemical compound with molecular formula C15H9Cl2NO3S and molecular weight 352.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-喹啉磺酸3,4-二氯苯酯
(3,4-dichlorophenyl) quinoline-8-sulfonate
Also Known As: 8-Quinolinesulfonic acid, 3,4-dichlorophenyl ester, (3,4-dichlorophenyl) quinoline-8-sulfonate, 3,4-DICHLOROPHENYL QUINOLINE-8-SULFONATE, Quinoline-8-sulfonic acid 3,4-dichlorophenyl ester
| Molecular Formula | C15H9Cl2NO3S |
|---|---|
| Molecular Weight | 352.97 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.96802 |
| Heavy Atoms | 22 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 158729-19-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)S(=O)(=O)OC3=CC(=C(C=C3)Cl)Cl)N=CC=C2 |
| InChIKey | HOYQRSSSYSSMPZ-UHFFFAOYSA-N |
Product Overview
8-喹啉磺酸3,4-二氯苯酯 (CAS 158729-19-2), with molecular formula C15H9Cl2NO3S and molecular weight 352.97 g/mol. IUPAC: (3,4-dichlorophenyl) quinoline-8-sulfonate.
Chemical Property Profile of 8-喹啉磺酸3,4-二氯苯酯
Property Insights of 8-喹啉磺酸3,4-二氯苯酯
The XLogP value of 4.5 indicates that 8-喹啉磺酸3,4-二氯苯酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-喹啉磺酸3,4-二氯苯酯. Following Lipinski's Rule of Five, 8-喹啉磺酸3,4-二氯苯酯 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-喹啉磺酸3,4-二氯苯酯?
The CAS number of 8-喹啉磺酸3,4-二氯苯酯 is 158729-19-2.
What is the molecular formula of 8-喹啉磺酸3,4-二氯苯酯?
The molecular formula of 8-喹啉磺酸3,4-二氯苯酯 is C15H9Cl2NO3S.
What is the molecular weight of 8-喹啉磺酸3,4-二氯苯酯?
The molecular weight of 8-喹啉磺酸3,4-二氯苯酯 is 352.97 g/mol.
Where can I buy 8-喹啉磺酸3,4-二氯苯酯?
You can request a quote for 8-喹啉磺酸3,4-二氯苯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-喹啉磺酸3,4-二氯苯酯?
Yes, KEHONG BIO provides custom synthesis services for 8-喹啉磺酸3,4-二氯苯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.