Thiepane, 1,1-dioxide
TL;DR: Thiepane, 1,1-dioxide (CAS 6251-33-8) is a chemical compound with molecular formula C6H12O2S and molecular weight 148.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thiepane 1,1-dioxide
Also Known As: Hexamethylene sulfone, thiepane 1,1-dioxide, Thiepane1,1-dioxide, Thiepane, 1,1-dioxide, hexahydrothiepin 1,1-dioxide
| Molecular Formula | C6H12O2S |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.0558 |
| Heavy Atoms | 9 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 6251-33-8 |
|---|---|
| SMILES | C1CCCS(=O)(=O)CC1 |
| InChIKey | CFRVORMUGQWQNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiepane, 1,1-dioxide (CAS 6251-33-8), with molecular formula C6H12O2S and molecular weight 148.06 g/mol. IUPAC: thiepane 1,1-dioxide.
Chemical Property Profile of Thiepane, 1,1-dioxide
Property Insights of Thiepane, 1,1-dioxide
The XLogP value of -0.1 indicates that Thiepane, 1,1-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.5 Ų, Thiepane, 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiepane, 1,1-dioxide has 0 hydrogen bond donor(s) and 2 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 Thiepane, 1,1-dioxide?
The CAS number of Thiepane, 1,1-dioxide is 6251-33-8.
What is the molecular formula of Thiepane, 1,1-dioxide?
The molecular formula of Thiepane, 1,1-dioxide is C6H12O2S.
What is the molecular weight of Thiepane, 1,1-dioxide?
The molecular weight of Thiepane, 1,1-dioxide is 148.06 g/mol.
Where can I buy Thiepane, 1,1-dioxide?
You can request a quote for Thiepane, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiepane, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Thiepane, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.