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2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate
TL;DR: 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate (CAS 219928-57-1) is a chemical compound with molecular formula C14H8ClNO2S and molecular weight 289.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-3-pyridinyl) 1-benzothiophene-2-carboxylate
Also Known As: 2-chloro-3-pyridyl benzo[b]thiophene-2-carboxylate, (2-chloropyridin-3-yl) 1-benzothiophene-2-carboxylate, 2-chloro-3-pyridylbenzo[b]thiophene-2-carboxylate, 2-chloropyridin-3-yl 1-benzothiophene-2-carboxylate
| Molecular Formula | C14H8ClNO2S |
|---|---|
| Molecular Weight | 289.00 g/mol |
| LogP | 4.1689 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.99643 |
| Heavy Atoms | 19 |
| Complexity | 720.7956 |
Chemical Identifiers
| CAS Number | 219928-57-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(S2)C(=O)OC3=C(N=CC=C3)Cl |
Product Overview
2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate (CAS 219928-57-1), with molecular formula C14H8ClNO2S and molecular weight 289.00 g/mol. IUPAC: (2-chloro-3-pyridinyl) 1-benzothiophene-2-carboxylate.
Chemical Property Profile of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate
Property Insights of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate
The XLogP value of 4.1689 indicates that 2-Chloro-3-pyridyl benzo[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 39.19 Ų, 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate has 0 hydrogen bond donor(s) and 4 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-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate?
The CAS number of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate is 219928-57-1.
What is the molecular formula of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate?
The molecular formula of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate is C14H8ClNO2S.
What is the molecular weight of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate?
The molecular weight of 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate is 289.00 g/mol.
Where can I buy 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate?
You can request a quote for 2-Chloro-3-pyridyl benzo[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-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-3-pyridyl benzo[b]thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.