1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
TL;DR: 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione (CAS 7512-53-0) is a chemical compound with molecular formula C23H18O3S2 and molecular weight 406.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
Also Known As: 1-benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione, 1-benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-d, 1-(Benzylsulfanyl)-8-[(2-hydroxyethyl)sulfanyl]anthracene-9,10-dione
| Molecular Formula | C23H18O3S2 |
|---|---|
| Molecular Weight | 406.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.06973 |
| Heavy Atoms | 28 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 7512-53-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4SCCO |
| InChIKey | XCWDHNAHNWATLG-UHFFFAOYSA-N |
Product Overview
1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione (CAS 7512-53-0), with molecular formula C23H18O3S2 and molecular weight 406.07 g/mol. IUPAC: 1-benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione.
Chemical Property Profile of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
Property Insights of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione
The XLogP value of 4.7 indicates that 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione. Following Lipinski's Rule of Five, 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione has 1 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 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione?
The CAS number of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione is 7512-53-0.
What is the molecular formula of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione?
The molecular formula of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione is C23H18O3S2.
What is the molecular weight of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione?
The molecular weight of 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione is 406.07 g/mol.
Where can I buy 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione?
You can request a quote for 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzylsulfanyl-8-(2-hydroxyethylsulfanyl)anthracene-9,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.