2-Bromobenzothiophene sulfoxide
TL;DR: 2-Bromobenzothiophene sulfoxide (CAS 57147-27-0) is a chemical compound with molecular formula C8H5BrOS and molecular weight 227.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-benzothiophene 1-oxide
Also Known As: 2-Bromobenzothiophene sulfoxide, 2-bromo-1-benzothiophene 1-oxide, 2-bromobenzo[b]thiophene 1-oxide, 2-Bromo-benzo(b)thiophene-1-oxide, 2-Bromo-1H-1-benzothiophen-1-one
| Molecular Formula | C8H5BrOS |
|---|---|
| Molecular Weight | 227.92 g/mol |
| LogP | 2.5011 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.92445 |
| Heavy Atoms | 11 |
| Complexity | 356.86462 |
Chemical Identifiers
| CAS Number | 57147-27-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(S2=O)Br |
Product Overview
2-Bromobenzothiophene sulfoxide (CAS 57147-27-0), with molecular formula C8H5BrOS and molecular weight 227.92 g/mol. IUPAC: 2-bromo-1-benzothiophene 1-oxide.
Chemical Property Profile of 2-Bromobenzothiophene sulfoxide
Property Insights of 2-Bromobenzothiophene sulfoxide
The XLogP value of 2.5011 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromobenzothiophene sulfoxide. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Bromobenzothiophene sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromobenzothiophene sulfoxide has 0 hydrogen bond donor(s) and 1 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 sulfoxide?
The CAS number of 2-Bromobenzothiophene sulfoxide is 57147-27-0.
What is the molecular formula of 2-Bromobenzothiophene sulfoxide?
The molecular formula of 2-Bromobenzothiophene sulfoxide is C8H5BrOS.
What is the molecular weight of 2-Bromobenzothiophene sulfoxide?
The molecular weight of 2-Bromobenzothiophene sulfoxide is 227.92 g/mol.
Where can I buy 2-Bromobenzothiophene sulfoxide?
You can request a quote for 2-Bromobenzothiophene sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromobenzothiophene sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromobenzothiophene sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.