![7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one structure](/static/products/1122/112272-08-9.webp)
7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one
TL;DR: 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one (CAS 112272-08-9) is a chemical compound with molecular formula C22H16O5S and molecular weight 392.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-3-phenylchromen-7-yl) 4-methylbenzenesulfonate
Also Known As: (4-oxo-3-phenylchromen-7-yl) 4-methylbenzenesulfonate, 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one, 4-Oxo-3-phenyl-4H-1-benzopyran-7-yl 4-methylbenzene-1-sulfonate
| Molecular Formula | C22H16O5S |
|---|---|
| Molecular Weight | 392.07 g/mol |
| LogP | 4.53612 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.07184 |
| Heavy Atoms | 28 |
| Complexity | 1304.8997 |
Chemical Identifiers
| CAS Number | 112272-08-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4 |
Product Overview
7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one (CAS 112272-08-9), with molecular formula C22H16O5S and molecular weight 392.07 g/mol. IUPAC: (4-oxo-3-phenylchromen-7-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one
Property Insights of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one
The XLogP value of 4.53612 indicates that 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one. Following Lipinski's Rule of Five, 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one 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 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one?
The CAS number of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one is 112272-08-9.
What is the molecular formula of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one?
The molecular formula of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one is C22H16O5S.
What is the molecular weight of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one?
The molecular weight of 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one is 392.07 g/mol.
Where can I buy 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one?
You can request a quote for 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[[(4-Methylphenyl)sulfonyl]oxy]-3-phenyl-4H-1-benzopyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.