![2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate structure](/static/products/3384/338418-79-4.webp)
2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate
TL;DR: 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate (CAS 338418-79-4) is a chemical compound with molecular formula C13H13N5O2S and molecular weight 303.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[1-amino-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethylidene]amino]pyridine-4-carboxamide
Also Known As: 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate, N-[[1-amino-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethylidene]amino]pyridine-4-carboxamide, N-[[1-amino-2-(1-oxidopyridin-6-yl)sulfanyl-ethylidene]amino]pyridine-4-carboxamide
| Molecular Formula | C13H13N5O2S |
|---|---|
| Molecular Weight | 303.08 g/mol |
| LogP | 0.5093 |
| Topological Polar Surface Area | 107.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.079 |
| Heavy Atoms | 21 |
| Complexity | 648.0197 |
Chemical Identifiers
| CAS Number | 338418-79-4 |
|---|---|
| SMILES | C1=CC=[N+](C(=C1)SCC(=NNC(=O)C2=CC=NC=C2)N)[O-] |
Product Overview
2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate (CAS 338418-79-4), with molecular formula C13H13N5O2S and molecular weight 303.08 g/mol. IUPAC: N-[[1-amino-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethylidene]amino]pyridine-4-carboxamide.
Chemical Property Profile of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate
Property Insights of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate
The XLogP value of 0.5093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate. The TPSA of 107.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate. Following Lipinski's Rule of Five, 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate has 2 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-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate?
The CAS number of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate is 338418-79-4.
What is the molecular formula of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate?
The molecular formula of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate is C13H13N5O2S.
What is the molecular weight of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate?
The molecular weight of 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate is 303.08 g/mol.
Where can I buy 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate?
You can request a quote for 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-amino-2-(2-isonicotinoylhydrazono)ethyl]sulfanyl}-1-pyridiniumolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.