2-Formylquinolin-8-yl 4-methylbenzenesulfonate
TL;DR: 2-Formylquinolin-8-yl 4-methylbenzenesulfonate (CAS 5475-50-3) is a chemical compound with molecular formula C17H13NO4S and molecular weight 327.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-formylquinolin-8-yl) 4-methylbenzenesulfonate
Also Known As: 2-Formylquinolin-8-yl 4-methylbenzenesulfonate, (2-formylquinolin-8-yl) 4-methylbenzenesulfonate, 2-formylquinolin-8-yl 4-methylbenzene-1-sulfonate, 2-Formylquinolin-8-yl4-methylbenzenesulfonate, (2-formyl-8-quinolyl) 4-methylbenzenesulfonate
| Molecular Formula | C17H13NO4S |
|---|---|
| Molecular Weight | 327.06 g/mol |
| LogP | 3.12342 |
| Topological Polar Surface Area | 73.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.05652 |
| Heavy Atoms | 23 |
| Complexity | 979.15094 |
Chemical Identifiers
| CAS Number | 5475-50-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)C=O |
Product Overview
2-Formylquinolin-8-yl 4-methylbenzenesulfonate (CAS 5475-50-3), with molecular formula C17H13NO4S and molecular weight 327.06 g/mol. IUPAC: (2-formylquinolin-8-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate
Property Insights of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate
The XLogP value of 3.12342 indicates that 2-Formylquinolin-8-yl 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Formylquinolin-8-yl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 2-Formylquinolin-8-yl 4-methylbenzenesulfonate has 0 hydrogen bond donor(s) and 5 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 2-Formylquinolin-8-yl 4-methylbenzenesulfonate?
The CAS number of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate is 5475-50-3.
What is the molecular formula of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate?
The molecular formula of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate is C17H13NO4S.
What is the molecular weight of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate?
The molecular weight of 2-Formylquinolin-8-yl 4-methylbenzenesulfonate is 327.06 g/mol.
Where can I buy 2-Formylquinolin-8-yl 4-methylbenzenesulfonate?
You can request a quote for 2-Formylquinolin-8-yl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Formylquinolin-8-yl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Formylquinolin-8-yl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.