2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate
TL;DR: 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate (CAS 7143-58-0) is a chemical compound with molecular formula C8H10N2O4S and molecular weight 230.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-carbamoylpyridin-1-ium-1-yl)ethanesulfonate
Also Known As: BAS 00665537, 2-(3-carbamoylpyridin-1-ium-1-yl)ethanesulfonate, 2-(3-Carbamoylpyridin-1-ium-1-yl)ethane-1-sulfonate
| Molecular Formula | C8H10N2O4S |
|---|---|
| Molecular Weight | 230.04 g/mol |
| LogP | -1.3818 |
| Topological Polar Surface Area | 104.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.03613 |
| Heavy Atoms | 15 |
| Complexity | 469.28494 |
Chemical Identifiers
| CAS Number | 7143-58-0 |
|---|---|
| SMILES | C1=CC(=C[N+](=C1)CCS(=O)(=O)[O-])C(=O)N |
Product Overview
2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate (CAS 7143-58-0), with molecular formula C8H10N2O4S and molecular weight 230.04 g/mol. IUPAC: 2-(3-carbamoylpyridin-1-ium-1-yl)ethanesulfonate.
Chemical Property Profile of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate
Property Insights of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate
The XLogP value of -1.3818 indicates that 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate. Following Lipinski's Rule of Five, 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate has 1 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-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate?
The CAS number of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate is 7143-58-0.
What is the molecular formula of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate?
The molecular formula of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate is C8H10N2O4S.
What is the molecular weight of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate?
The molecular weight of 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate is 230.04 g/mol.
Where can I buy 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate?
You can request a quote for 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Carbamoylpyridin-1-ium-1-yl)ethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.