3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride
TL;DR: 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride (CAS 52354-19-5) is a chemical compound with molecular formula C14H15ClN2O and molecular weight 262.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methylphenyl)methyl]pyridin-1-ium-3-carboxamide chloride
Also Known As: 3-(aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride, 1-(4-Methylbenzyl)-3-carbamoylpyridinium chloride, 1-[(4-methylphenyl)methyl]pyridine-5-carboxamide Chloride, 1-[(4-methylphenyl)methyl]pyridin-1-ium-3-carboxamide chloride, 3-carbamoyl-1-[(4-methylphenyl)methyl]pyridin-1-ium chloride
| Molecular Formula | C14H15ClN2O |
|---|---|
| Molecular Weight | 262.09 g/mol |
| LogP | -1.56628 |
| Topological Polar Surface Area | 46.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.08728 |
| Heavy Atoms | 18 |
| Complexity | 537.7452 |
Chemical Identifiers
| CAS Number | 52354-19-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N.[Cl-] |
Product Overview
3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride (CAS 52354-19-5), with molecular formula C14H15ClN2O and molecular weight 262.09 g/mol. IUPAC: 1-[(4-methylphenyl)methyl]pyridin-1-ium-3-carboxamide chloride.
Chemical Property Profile of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride
Property Insights of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride
The XLogP value of -1.56628 indicates that 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.97 Ų, 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride has 1 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 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride?
The CAS number of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride is 52354-19-5.
What is the molecular formula of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride?
The molecular formula of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride is C14H15ClN2O.
What is the molecular weight of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride?
The molecular weight of 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride is 262.09 g/mol.
Where can I buy 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride?
You can request a quote for 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(Aminocarbonyl)-1-(4-methylbenzyl)pyridinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.