2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate
TL;DR: 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate (CAS 825602-41-3) is a chemical compound with molecular formula C17H12O4S and molecular weight 312.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-2-thiophen-2-ylethyl) 3-hydroxynaphthalene-2-carboxylate
Also Known As: 2-oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate, (2-oxo-2-thiophen-2-ylethyl) 3-hydroxynaphthalene-2-carboxylate
| Molecular Formula | C17H12O4S |
|---|---|
| Molecular Weight | 312.05 g/mol |
| LogP | 3.6466 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.04562 |
| Heavy Atoms | 22 |
| Complexity | 836.99603 |
Chemical Identifiers
| CAS Number | 825602-41-3 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)C(=O)OCC(=O)C3=CC=CS3)O |
Product Overview
2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate (CAS 825602-41-3), with molecular formula C17H12O4S and molecular weight 312.05 g/mol. IUPAC: (2-oxo-2-thiophen-2-ylethyl) 3-hydroxynaphthalene-2-carboxylate.
Chemical Property Profile of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate
Property Insights of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate
The XLogP value of 3.6466 indicates that 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate. Following Lipinski's Rule of Five, 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate has 1 hydrogen bond donor(s) and 5 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-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate?
The CAS number of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate is 825602-41-3.
What is the molecular formula of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate?
The molecular formula of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate is C17H12O4S.
What is the molecular weight of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate?
The molecular weight of 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate is 312.05 g/mol.
Where can I buy 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate?
You can request a quote for 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-(2-thienyl)ethyl 3-hydroxy-2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.