3-Chlorobenzothiophene sulfoxide
TL;DR: 3-Chlorobenzothiophene sulfoxide (CAS 63724-95-8) is a chemical compound with molecular formula C8H5ClOS and molecular weight 183.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-benzothiophene 1-oxide
Also Known As: 3-Chlorobenzothiophene sulfoxide, 3-chloro-1-benzothiophene 1-oxide, 3-chlorobenzo[b]thiophene 1-oxide, 3-Chloro-benzo(b)thiophene-1-oxide, 3-Chloro-1H-1-benzothiophen-1-one
| Molecular Formula | C8H5ClOS |
|---|---|
| Molecular Weight | 183.97 g/mol |
| LogP | 2.345 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.97496 |
| Heavy Atoms | 11 |
| Complexity | 356.86462 |
Chemical Identifiers
| CAS Number | 63724-95-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CS2=O)Cl |
Product Overview
3-Chlorobenzothiophene sulfoxide (CAS 63724-95-8), with molecular formula C8H5ClOS and molecular weight 183.97 g/mol. IUPAC: 3-chloro-1-benzothiophene 1-oxide.
Chemical Property Profile of 3-Chlorobenzothiophene sulfoxide
Property Insights of 3-Chlorobenzothiophene sulfoxide
The XLogP value of 2.345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chlorobenzothiophene sulfoxide. With a topological polar surface area (TPSA) of 17.07 Ų, 3-Chlorobenzothiophene sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chlorobenzothiophene 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 3-Chlorobenzothiophene sulfoxide?
The CAS number of 3-Chlorobenzothiophene sulfoxide is 63724-95-8.
What is the molecular formula of 3-Chlorobenzothiophene sulfoxide?
The molecular formula of 3-Chlorobenzothiophene sulfoxide is C8H5ClOS.
What is the molecular weight of 3-Chlorobenzothiophene sulfoxide?
The molecular weight of 3-Chlorobenzothiophene sulfoxide is 183.97 g/mol.
Where can I buy 3-Chlorobenzothiophene sulfoxide?
You can request a quote for 3-Chlorobenzothiophene sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chlorobenzothiophene sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chlorobenzothiophene sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.