3-Carbamyl-1-methylpyridinium Chloride
TL;DR: 3-Carbamyl-1-methylpyridinium Chloride (CAS 1005-24-9) is a chemical compound with molecular formula C7H9ClN2O and molecular weight 172.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylpyridin-1-ium-3-carboxamide chloride
Also Known As: 1-Methylnicotinamide chloride, 3-Carbamyl-1-methylpyridinium chloride, Trigonellamide chloride, 3-carbamoyl-1-methylpyridin-1-ium chloride, Nicotinamide Chloromethylate
| Molecular Formula | C7H9ClN2O |
|---|---|
| Molecular Weight | 172.04 g/mol |
| LogP | -3.39 |
| Topological Polar Surface Area | 47.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.04034 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 1005-24-9 |
|---|---|
| SMILES | C[N+]1=CC=CC(=C1)C(=O)N.[Cl-] |
| InChIKey | BWVDQVQUNNBTLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Carbamyl-1-methylpyridinium Chloride (CAS 1005-24-9), with molecular formula C7H9ClN2O and molecular weight 172.04 g/mol. IUPAC: 1-methylpyridin-1-ium-3-carboxamide chloride.
Chemical Property Profile of 3-Carbamyl-1-methylpyridinium Chloride
Property Insights of 3-Carbamyl-1-methylpyridinium Chloride
The XLogP value of -3.39 indicates that 3-Carbamyl-1-methylpyridinium Chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.0 Ų, 3-Carbamyl-1-methylpyridinium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Carbamyl-1-methylpyridinium Chloride has 1 hydrogen bond donor(s) and 2 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-Carbamyl-1-methylpyridinium Chloride?
The CAS number of 3-Carbamyl-1-methylpyridinium Chloride is 1005-24-9.
What is the molecular formula of 3-Carbamyl-1-methylpyridinium Chloride?
The molecular formula of 3-Carbamyl-1-methylpyridinium Chloride is C7H9ClN2O.
What is the molecular weight of 3-Carbamyl-1-methylpyridinium Chloride?
The molecular weight of 3-Carbamyl-1-methylpyridinium Chloride is 172.04 g/mol.
Where can I buy 3-Carbamyl-1-methylpyridinium Chloride?
You can request a quote for 3-Carbamyl-1-methylpyridinium Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carbamyl-1-methylpyridinium Chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Carbamyl-1-methylpyridinium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.