1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride
TL;DR: 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride (CAS 19518-27-5) is a chemical compound with molecular formula C16H16ClNO and molecular weight 273.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)prop-2-en-1-one chloride
Also Known As: 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride, 3-Methyl-N-[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]pyridinium chloride, (E)-1-(4-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)prop-2-en-1-one;chloride, (2E)-1-(4-methylphenyl)-3-(3-methylpyridyl)prop-2-en-1-one, chloride, (E)-1-(4-methylphenyl)-3-(5-methylpyridin-1-yl)prop-2-en-1-one Chloride
| Molecular Formula | C16H16ClNO |
|---|---|
| Molecular Weight | 273.09 g/mol |
| LogP | -0.05146 |
| Topological Polar Surface Area | 20.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.09204 |
| Heavy Atoms | 19 |
| Complexity | 587.9529 |
Chemical Identifiers
| CAS Number | 19518-27-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)/C=C/[N+]2=CC=CC(=C2)C.[Cl-] |
Product Overview
1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride (CAS 19518-27-5), with molecular formula C16H16ClNO and molecular weight 273.09 g/mol. IUPAC: (E)-1-(4-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)prop-2-en-1-one chloride.
Chemical Property Profile of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride
Property Insights of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride
The XLogP value of -0.05146 indicates that 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.95 Ų, 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride has 0 hydrogen bond donor(s) and 1 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-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride?
The CAS number of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride is 19518-27-5.
What is the molecular formula of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride?
The molecular formula of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride is C16H16ClNO.
What is the molecular weight of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride?
The molecular weight of 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride is 273.09 g/mol.
Where can I buy 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride?
You can request a quote for 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)-3-(3-methylpyridinium-1-yl)prop-2-en-1-one chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.