1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone
TL;DR: 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone (CAS 3319-54-8) is a chemical compound with molecular formula C16H12O5S and molecular weight 316.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydroxy-2-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
Also Known As: 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone, 1,4-dihydroxy-2-[ thio]anthraquinone, 1,4-dihydroxy-2-[(2-hydroxyethyl)thio]anthraquinone, 1,4-dihydroxy-2-((2-hydroxyethyl)thio)anthracene-9,10-dione, 1,4-Dihydroxy-2-(2-hydroxyethylthio)anthraquinone
| Molecular Formula | C16H12O5S |
|---|---|
| Molecular Weight | 316.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.04056 |
| Heavy Atoms | 22 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 3319-54-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)SCCO)O |
| InChIKey | MEPIQIDDESKQAQ-UHFFFAOYSA-N |
Product Overview
1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone (CAS 3319-54-8), with molecular formula C16H12O5S and molecular weight 316.04 g/mol. IUPAC: 1,4-dihydroxy-2-(2-hydroxyethylsulfanyl)anthracene-9,10-dione.
Chemical Property Profile of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone
Property Insights of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone
The XLogP value of 3.1 indicates that 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone. Following Lipinski's Rule of Five, 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone has 3 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 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone?
The CAS number of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone is 3319-54-8.
What is the molecular formula of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone?
The molecular formula of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone is C16H12O5S.
What is the molecular weight of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone?
The molecular weight of 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone is 316.04 g/mol.
Where can I buy 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone?
You can request a quote for 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dihydroxy-2-((2-hydroxyethyl)thio)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.