![2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate structure](/static/products/833/833437-72-2.png)
2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate
TL;DR: 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate (CAS 833437-72-2) is a chemical compound with molecular formula C15H8ClFO2S and molecular weight 305.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-fluorophenyl) 3-chloro-1-benzothiophene-2-carboxylate
Also Known As: 2-fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate, 2-fluorophenyl 3-chloro-1-benzothiophene-2-carboxylate, (2-fluorophenyl) 3-chloro-1-benzothiophene-2-carboxylate
| Molecular Formula | C15H8ClFO2S |
|---|---|
| Molecular Weight | 305.99 g/mol |
| LogP | 4.913 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.99176 |
| Heavy Atoms | 20 |
| Complexity | 797.4228 |
Chemical Identifiers
| CAS Number | 833437-72-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)OC3=CC=CC=C3F)Cl |
Product Overview
2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate (CAS 833437-72-2), with molecular formula C15H8ClFO2S and molecular weight 305.99 g/mol. IUPAC: (2-fluorophenyl) 3-chloro-1-benzothiophene-2-carboxylate.
Chemical Property Profile of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate
Property Insights of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate
The XLogP value of 4.913 indicates that 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate 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 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate?
The CAS number of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate is 833437-72-2.
What is the molecular formula of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate?
The molecular formula of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate is C15H8ClFO2S.
What is the molecular weight of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate?
The molecular weight of 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate is 305.99 g/mol.
Where can I buy 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate?
You can request a quote for 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluorophenyl 3-chlorobenzo[b]thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.