1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone
TL;DR: 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone (CAS 16673-01-1) is a chemical compound with molecular formula C21H14O4S and molecular weight 362.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-4-(4-methoxyphenyl)sulfanylanthracene-9,10-dione
Also Known As: 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone, 1-hydroxy-4-(4-methoxyphenyl)sulfanylanthracene-9,10-dione, 1-hydroxy-4-[(4-methoxyphenyl)thio]anthraquinone, 1-Hydroxy-4-((4-methoxyphenyl)thio)anthracene-9,10-dione, 1-Hydroxy-4-[(4-methoxyphenyl)thio]-9,10-anthracenedione
| Molecular Formula | C21H14O4S |
|---|---|
| Molecular Weight | 362.06 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.06128 |
| Heavy Atoms | 26 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 16673-01-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O |
| InChIKey | GPKKHRIXFZCDJC-UHFFFAOYSA-N |
Product Overview
1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone (CAS 16673-01-1), with molecular formula C21H14O4S and molecular weight 362.06 g/mol. IUPAC: 1-hydroxy-4-(4-methoxyphenyl)sulfanylanthracene-9,10-dione.
Chemical Property Profile of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone
Property Insights of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone
The XLogP value of 5.1 indicates that 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone. Following Lipinski's Rule of Five, 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone?
The CAS number of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone is 16673-01-1.
What is the molecular formula of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone?
The molecular formula of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone is C21H14O4S.
What is the molecular weight of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone?
The molecular weight of 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone is 362.06 g/mol.
Where can I buy 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone?
You can request a quote for 1-Hydroxy-4-((4-methoxyphenyl)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-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-4-((4-methoxyphenyl)thio)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.