Dibenzothiophene sulfone
TL;DR: Dibenzothiophene sulfone (CAS 1016-05-3) is a chemical compound with molecular formula C12H8O2S and molecular weight 216.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzothiophene 5,5-dioxide
Also Known As: Dibenzothiophene sulfone, Dibenzo[b,d]thiophene 5,5-dioxide, Dibenzothiophene 5,5-dioxide, Dibenzothiophene-5,5-dioxide, Dibenzothiophene dioxide
| Molecular Formula | C12H8O2S |
|---|---|
| Molecular Weight | 216.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.0245 |
| Heavy Atoms | 15 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 1016-05-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3S2(=O)=O |
| InChIKey | IKJFYINYNJYDTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzothiophene sulfone (CAS 1016-05-3), with molecular formula C12H8O2S and molecular weight 216.02 g/mol. IUPAC: dibenzothiophene 5,5-dioxide.
Chemical Property Profile of Dibenzothiophene sulfone
Property Insights of Dibenzothiophene sulfone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibenzothiophene sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, Dibenzothiophene sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzothiophene sulfone 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 Dibenzothiophene sulfone?
The CAS number of Dibenzothiophene sulfone is 1016-05-3.
What is the molecular formula of Dibenzothiophene sulfone?
The molecular formula of Dibenzothiophene sulfone is C12H8O2S.
What is the molecular weight of Dibenzothiophene sulfone?
The molecular weight of Dibenzothiophene sulfone is 216.02 g/mol.
Where can I buy Dibenzothiophene sulfone?
You can request a quote for Dibenzothiophene sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzothiophene sulfone?
Yes, KEHONG BIO provides custom synthesis services for Dibenzothiophene sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.