1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one
TL;DR: 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one (CAS 692716-75-9) is a chemical compound with molecular formula C14H13ClNO+ and molecular weight 246.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-(3-methylpyridin-1-ium-1-yl)ethanone
Also Known As: BAS 01248463, 1-(4-chlorophenyl)-2-(3-methylpyridyl)ethan-1-one, 1-[2-(4-Chloro-phenyl)-2-oxo-ethyl]-3-methyl-pyridinium, 1-(4-chlorophenyl)-2-(3-methylpyridin-1-ium-1-yl)ethanone
| Molecular Formula | C14H13ClNO+ |
|---|---|
| Molecular Weight | 246.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 21.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.06857 |
| Heavy Atoms | 17 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 692716-75-9 |
|---|---|
| SMILES | CC1=C[N+](=CC=C1)CC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | UUAGQILVJBDPIQ-UHFFFAOYSA-N |
Product Overview
1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one (CAS 692716-75-9), with molecular formula C14H13ClNO+ and molecular weight 246.07 g/mol. IUPAC: 1-(4-chlorophenyl)-2-(3-methylpyridin-1-ium-1-yl)ethanone.
Chemical Property Profile of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one
Property Insights of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one
The XLogP value of 3.5 indicates that 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.0 Ų, 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one 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-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one?
The CAS number of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one is 692716-75-9.
What is the molecular formula of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one?
The molecular formula of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one is C14H13ClNO+.
What is the molecular weight of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one?
The molecular weight of 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one is 246.07 g/mol.
Where can I buy 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one?
You can request a quote for 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-2-(3-methylpyridyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.