3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide
TL;DR: 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide (CAS 28494-45-3) is a chemical compound with molecular formula C14H9ClO2S2 and molecular weight 307.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide
Also Known As: 3-(4-chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide, 3-[(4-chlorophenyl)sulfanyl]-1-benzothiophene 1,1-dioxide, AP-853/41543800, 3-((4-chlorophenyl)thio)benzo[b]thiophene 1,1-dioxide
| Molecular Formula | C14H9ClO2S2 |
|---|---|
| Molecular Weight | 307.97 g/mol |
| LogP | 4.218 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.97324 |
| Heavy Atoms | 19 |
| Complexity | 762.2879 |
Chemical Identifiers
| CAS Number | 28494-45-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CS2(=O)=O)SC3=CC=C(C=C3)Cl |
Product Overview
3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide (CAS 28494-45-3), with molecular formula C14H9ClO2S2 and molecular weight 307.97 g/mol. IUPAC: 3-(4-chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide.
Chemical Property Profile of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide
Property Insights of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide
The XLogP value of 4.218 indicates that 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide has 0 hydrogen bond donor(s) and 3 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-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide?
The CAS number of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide is 28494-45-3.
What is the molecular formula of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide?
The molecular formula of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide is C14H9ClO2S2.
What is the molecular weight of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide?
The molecular weight of 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide is 307.97 g/mol.
Where can I buy 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide?
You can request a quote for 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 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 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)sulfanyl-1-benzothiophene 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.