N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)
TL;DR: N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) (CAS 54231-54-8) 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.
(3,4-dimethylphenyl)-(pyridine-4-carbonyl)azanium chloride
Also Known As: N-(3,4-Xylyl)isonicotinamide hydrochloride, Isonicotinamide, N-(3,4-xylyl)-, hydrochloride, N-(3,4-Dimethylphenyl) isonicotinamide hydrochloride, ISONICOTINAMIDE, N-(3,4-DIMETHYLPHENYL)-, HYDROCHLORIDE, (3,4-dimethylphenyl)-(pyridine-4-carbonyl)azanium chloride
| Molecular Formula | C14H15ClN2O |
|---|---|
| Molecular Weight | 262.09 g/mol |
| LogP | -1.26 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.08728 |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 54231-54-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[NH2+]C(=O)C2=CC=NC=C2)C.[Cl-] |
| InChIKey | WLQUAZIPFVGROS-UHFFFAOYSA-N |
Product Overview
N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) (CAS 54231-54-8), with molecular formula C14H15ClN2O and molecular weight 262.09 g/mol. IUPAC: (3,4-dimethylphenyl)-(pyridine-4-carbonyl)azanium chloride.
Chemical Property Profile of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)
Property Insights of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)
The XLogP value of -1.26 indicates that N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.6 Ų, N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 3 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 N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)?
The CAS number of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) is 54231-54-8.
What is the molecular formula of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)?
The molecular formula of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) is C14H15ClN2O.
What is the molecular weight of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)?
The molecular weight of N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) is 262.09 g/mol.
Where can I buy N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)?
You can request a quote for N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-Dimethylphenyl)pyridine-4-carboximidic acid--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.