![[1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi structure](/static/products/279/27918-50-9.png)
[1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi
TL;DR: [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi (CAS 27918-50-9) is a chemical compound with molecular formula C14H17Cl2N3O2S and molecular weight 361.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine dichloride
Also Known As: [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi
| Molecular Formula | C14H17Cl2N3O2S |
|---|---|
| Molecular Weight | 361.04 g/mol |
| LogP | -4.5686 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.04184 |
| Heavy Atoms | 22 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 27918-50-9 |
|---|---|
| SMILES | CSC1=C[N+](=CC=C1)COC[N+]2=CC=C(C=C2)C=NO.[Cl-].[Cl-] |
| InChIKey | DFHOFZCYJXUGPD-UHFFFAOYSA-M |
Product Overview
[1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi (CAS 27918-50-9), with molecular formula C14H17Cl2N3O2S and molecular weight 361.04 g/mol. IUPAC: N-[[1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine dichloride.
Chemical Property Profile of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi
Property Insights of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi
The XLogP value of -4.5686 indicates that [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi. Following Lipinski's Rule of Five, [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi 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 [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi?
The CAS number of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi is 27918-50-9.
What is the molecular formula of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi?
The molecular formula of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi is C14H17Cl2N3O2S.
What is the molecular weight of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi?
The molecular weight of [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi is 361.04 g/mol.
Where can I buy [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi?
You can request a quote for [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi?
Yes, KEHONG BIO provides custom synthesis services for [1-[(3-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridi and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.