2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate
TL;DR: 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate (CAS 853700-86-4) is a chemical compound with molecular formula C14H13NO5S2 and molecular weight 339.02 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-(methanesulfonamido)benzoate
Also Known As: AB00733294-01, 2-oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate, (2-oxo-2-thiophen-2-ylethyl) 3-(methanesulfonamido)benzoate, 2-oxo-2-(2-thienyl)ethyl 3-[(methylsulfonyl)amino]benzoate
| Molecular Formula | C14H13NO5S2 |
|---|---|
| Molecular Weight | 339.02 g/mol |
| LogP | 2.1593 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.02353 |
| Heavy Atoms | 22 |
| Complexity | 781.32434 |
Chemical Identifiers
| CAS Number | 853700-86-4 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=CS2 |
Product Overview
2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate (CAS 853700-86-4), with molecular formula C14H13NO5S2 and molecular weight 339.02 g/mol. IUPAC: (2-oxo-2-thiophen-2-ylethyl) 3-(methanesulfonamido)benzoate.
Chemical Property Profile of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate
Property Insights of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate
The XLogP value of 2.1593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate. Following Lipinski's Rule of Five, 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate has 1 hydrogen bond donor(s) and 6 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-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate?
The CAS number of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate is 853700-86-4.
What is the molecular formula of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate?
The molecular formula of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate is C14H13NO5S2.
What is the molecular weight of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate?
The molecular weight of 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate is 339.02 g/mol.
Where can I buy 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate?
You can request a quote for 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate 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-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-(thiophen-2-yl)ethyl 3-methanesulfonamidobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.