2-Bromobenzothiophene sulfone
TL;DR: 2-Bromobenzothiophene sulfone (CAS 5350-05-0) is a chemical compound with molecular formula C8H5BrO2S and molecular weight 243.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-benzothiophene 1,1-dioxide
Also Known As: 2-Bromobenzothiophene sulfone, 2-Bromobenzo[b]thiophene 1,1-dioxide, 2-Bromo-1-benzothiophene 1,1-dioxide, 2-Bromobenzothiophenesulfone, 2-Bromothianaphthene 1,1-dioxide
| Molecular Formula | C8H5BrO2S |
|---|---|
| Molecular Weight | 243.92 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 243.91936 |
| Heavy Atoms | 12 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 5350-05-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(S2(=O)=O)Br |
| InChIKey | GSNSVTOQAJSJSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromobenzothiophene sulfone (CAS 5350-05-0), with molecular formula C8H5BrO2S and molecular weight 243.92 g/mol. IUPAC: 2-bromo-1-benzothiophene 1,1-dioxide.
Chemical Property Profile of 2-Bromobenzothiophene sulfone
Property Insights of 2-Bromobenzothiophene sulfone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromobenzothiophene sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, 2-Bromobenzothiophene sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromobenzothiophene 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 2-Bromobenzothiophene sulfone?
The CAS number of 2-Bromobenzothiophene sulfone is 5350-05-0.
What is the molecular formula of 2-Bromobenzothiophene sulfone?
The molecular formula of 2-Bromobenzothiophene sulfone is C8H5BrO2S.
What is the molecular weight of 2-Bromobenzothiophene sulfone?
The molecular weight of 2-Bromobenzothiophene sulfone is 243.92 g/mol.
Where can I buy 2-Bromobenzothiophene sulfone?
You can request a quote for 2-Bromobenzothiophene sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromobenzothiophene sulfone?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromobenzothiophene sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.