2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate
TL;DR: 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate (CAS 6856-39-9) is a chemical compound with molecular formula C24H20O6S and molecular weight 436.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] 4-methylbenzenesulfonate
Also Known As: 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate, [2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] 4-methylbenzenesulfonate
| Molecular Formula | C24H20O6S |
|---|---|
| Molecular Weight | 436.10 g/mol |
| LogP | 4.85314 |
| Topological Polar Surface Area | 82.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.09805 |
| Heavy Atoms | 31 |
| Complexity | 1416.4115 |
Chemical Identifiers
| CAS Number | 6856-39-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=C(OC3=C(C2=O)C=CC(=C3)C)C4=CC=C(C=C4)OC |
Product Overview
2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate (CAS 6856-39-9), with molecular formula C24H20O6S and molecular weight 436.10 g/mol. IUPAC: [2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] 4-methylbenzenesulfonate.
Chemical Property Profile of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate
Property Insights of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate
The XLogP value of 4.85314 indicates that 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate has 0 hydrogen bond donor(s) and 6 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-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate?
The CAS number of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate is 6856-39-9.
What is the molecular formula of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate?
The molecular formula of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate is C24H20O6S.
What is the molecular weight of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate?
The molecular weight of 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate is 436.10 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate?
You can request a quote for 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-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 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-3-yl 4-methylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.