![Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate structure](/static/products/4339/433973-79-6.webp)
Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate
TL;DR: Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate (CAS 433973-79-6) is a chemical compound with molecular formula C20H15IO5S and molecular weight 493.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 4-(4-iodophenyl)sulfonyloxybenzoate
Also Known As: benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate, benzyl 4-(4-iodophenyl)sulfonyloxybenzoate, benzyl 4-{[(4-iodophenyl)sulfonyl]oxy}benzoate, phenylmethyl 4-[(4-iodophenyl)sulfonyloxy]benzoate
| Molecular Formula | C20H15IO5S |
|---|---|
| Molecular Weight | 493.97 g/mol |
| LogP | 4.4159 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.96848 |
| Heavy Atoms | 27 |
| Complexity | 1014.23193 |
Chemical Identifiers
| CAS Number | 433973-79-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)I |
Product Overview
Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate (CAS 433973-79-6), with molecular formula C20H15IO5S and molecular weight 493.97 g/mol. IUPAC: benzyl 4-(4-iodophenyl)sulfonyloxybenzoate.
Chemical Property Profile of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate
Property Insights of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate
The XLogP value of 4.4159 indicates that Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate. Following Lipinski's Rule of Five, Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate 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 Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate?
The CAS number of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate is 433973-79-6.
What is the molecular formula of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate?
The molecular formula of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate is C20H15IO5S.
What is the molecular weight of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate?
The molecular weight of Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate is 493.97 g/mol.
Where can I buy Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate?
You can request a quote for Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 4-[(4-iodobenzenesulfonyl)oxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.