Thianthrene, 5,5-dioxide
TL;DR: Thianthrene, 5,5-dioxide (CAS 2362-53-0) is a chemical compound with molecular formula C12H8O2S2 and molecular weight 248.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thianthrene 5,5-dioxide
Also Known As: Thianthrene, 5,5-dioxide, thianthrene 5,5-dioxide, thianthrene-5,5-dioxide, thianthren 5,5-dioxid, Thianthrene5,5-dioxide
| Molecular Formula | C12H8O2S2 |
|---|---|
| Molecular Weight | 248.00 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 247.99657 |
| Heavy Atoms | 16 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 2362-53-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)SC3=CC=CC=C3S2(=O)=O |
| InChIKey | YAOMBFIYBNUKHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thianthrene, 5,5-dioxide (CAS 2362-53-0), with molecular formula C12H8O2S2 and molecular weight 248.00 g/mol. IUPAC: thianthrene 5,5-dioxide.
Chemical Property Profile of Thianthrene, 5,5-dioxide
Property Insights of Thianthrene, 5,5-dioxide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thianthrene, 5,5-dioxide. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Thianthrene, 5,5-dioxide. Following Lipinski's Rule of Five, Thianthrene, 5,5-dioxide has 0 hydrogen bond donor(s) and 3 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 Thianthrene, 5,5-dioxide?
The CAS number of Thianthrene, 5,5-dioxide is 2362-53-0.
What is the molecular formula of Thianthrene, 5,5-dioxide?
The molecular formula of Thianthrene, 5,5-dioxide is C12H8O2S2.
What is the molecular weight of Thianthrene, 5,5-dioxide?
The molecular weight of Thianthrene, 5,5-dioxide is 248.00 g/mol.
Where can I buy Thianthrene, 5,5-dioxide?
You can request a quote for Thianthrene, 5,5-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thianthrene, 5,5-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Thianthrene, 5,5-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.