Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)
TL;DR: Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) (CAS 56923-38-7) is a chemical compound with molecular formula C18H18O6S and molecular weight 362.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(3-ethoxycarbonyl-4-hydroxyphenyl)sulfanyl-2-hydroxybenzoate
Also Known As: diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate), Diethyl 5,5'-thiobis(2-hydroxybenzoate), ethyl 5-{[3-(ethoxycarbonyl)-4-hydroxyphenyl]sulfanyl}-2-hydroxybenzoate, ethyl 5-(3-ethoxycarbonyl-4-hydroxyphenyl)sulfanyl-2-hydroxybenzoate, ethyl 5-[3-(ethoxycarbonyl)-4-hydroxyphenylthio]-2-hydroxybenzoate
| Molecular Formula | C18H18O6S |
|---|---|
| Molecular Weight | 362.08 g/mol |
| LogP | 3.6024 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.0824 |
| Heavy Atoms | 25 |
| Complexity | 721.6309 |
Chemical Identifiers
| CAS Number | 56923-38-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1)SC2=CC(=C(C=C2)O)C(=O)OCC)O |
Product Overview
Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) (CAS 56923-38-7), with molecular formula C18H18O6S and molecular weight 362.08 g/mol. IUPAC: ethyl 5-(3-ethoxycarbonyl-4-hydroxyphenyl)sulfanyl-2-hydroxybenzoate.
Chemical Property Profile of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)
Property Insights of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)
The XLogP value of 3.6024 indicates that Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate). Following Lipinski's Rule of Five, Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) has 2 hydrogen bond donor(s) and 7 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 Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)?
The CAS number of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) is 56923-38-7.
What is the molecular formula of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)?
The molecular formula of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) is C18H18O6S.
What is the molecular weight of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)?
The molecular weight of Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) is 362.08 g/mol.
Where can I buy Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)?
You can request a quote for Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate)?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3,3'-sulfanediylbis(6-hydroxybenzoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.