![[1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y structure](/static/products/278/27844-71-9.png)
[1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y
TL;DR: [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y (CAS 27844-71-9) is a chemical compound with molecular formula C15H19Br2N3O3S and molecular weight 478.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine dibromide
Also Known As: [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y
| Molecular Formula | C15H19Br2N3O3S |
|---|---|
| Molecular Weight | 478.95 g/mol |
| LogP | -5.4285 |
| Topological Polar Surface Area | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.9514 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 27844-71-9 |
|---|---|
| SMILES | CS(=O)(=O)C1=C[N+](=CC=C1)CCC[N+]2=CC=C(C=C2)C=NO.[Br-].[Br-] |
| InChIKey | IXSWSUUPSSSUHY-UHFFFAOYSA-M |
Product Overview
[1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y (CAS 27844-71-9), with molecular formula C15H19Br2N3O3S and molecular weight 478.95 g/mol. IUPAC: N-[[1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine dibromide.
Chemical Property Profile of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y
Property Insights of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y
The XLogP value of -5.4285 indicates that [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y. Following Lipinski's Rule of Five, [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y 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-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y?
The CAS number of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y is 27844-71-9.
What is the molecular formula of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y?
The molecular formula of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y is C15H19Br2N3O3S.
What is the molecular weight of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y?
The molecular weight of [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y is 478.95 g/mol.
Where can I buy [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y?
You can request a quote for [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y?
Yes, KEHONG BIO provides custom synthesis services for [1-[3-(3-methylsulfonylpyridin-1-ium-1-yl)propyl]pyridin-4-y and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.