5-(Benzoylamino)-2-methoxy-1-pyridiniumolate
TL;DR: 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate (CAS 400074-18-2) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-methoxy-1-oxidopyridin-1-ium-3-yl)benzamide
Also Known As: 5-(benzoylamino)-2-methoxy-1-pyridiniumolate, N-(6-methoxy-1-oxidopyridin-1-ium-3-yl)benzamide, 10J-345S, 5-benzamido-2-methoxypyridin-1-ium-1-olate
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 1.5809 |
| Topological Polar Surface Area | 65.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 555.4177 |
Chemical Identifiers
| CAS Number | 400074-18-2 |
|---|---|
| SMILES | COC1=[N+](C=C(C=C1)NC(=O)C2=CC=CC=C2)[O-] |
Product Overview
5-(Benzoylamino)-2-methoxy-1-pyridiniumolate (CAS 400074-18-2), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: N-(6-methoxy-1-oxidopyridin-1-ium-3-yl)benzamide.
Chemical Property Profile of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate
Property Insights of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate
The XLogP value of 1.5809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate. The TPSA of 65.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate. Following Lipinski's Rule of Five, 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate has 1 hydrogen bond donor(s) and 3 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 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate?
The CAS number of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate is 400074-18-2.
What is the molecular formula of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate?
The molecular formula of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate is C13H12N2O3.
What is the molecular weight of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate?
The molecular weight of 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate is 244.08 g/mol.
Where can I buy 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate?
You can request a quote for 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate?
Yes, KEHONG BIO provides custom synthesis services for 5-(Benzoylamino)-2-methoxy-1-pyridiniumolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.