5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium
TL;DR: 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium (CAS 787485-56-7) is a chemical compound with molecular formula C15H17N2O+ and molecular weight 241.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4,6-dimethylpyridin-1-ium-3-carboxamide
Also Known As: 5-(aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium, 1-benzyl-4,6-dimethylpyridin-1-ium-3-carboxamide, 4,6-dimethyl-1-benzylpyridine-3-carboxamide, 1-Benzyl-5-carbamoyl-2,4-dimethylpyridin-1-ium
| Molecular Formula | C15H17N2O+ |
|---|---|
| Molecular Weight | 241.13 g/mol |
| LogP | 1.73814 |
| Topological Polar Surface Area | 46.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.1341 |
| Heavy Atoms | 18 |
| Complexity | 576.5475 |
Chemical Identifiers
| CAS Number | 787485-56-7 |
|---|---|
| SMILES | CC1=CC(=[N+](C=C1C(=O)N)CC2=CC=CC=C2)C |
Product Overview
5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium (CAS 787485-56-7), with molecular formula C15H17N2O+ and molecular weight 241.13 g/mol. IUPAC: 1-benzyl-4,6-dimethylpyridin-1-ium-3-carboxamide.
Chemical Property Profile of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium
Property Insights of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium
The XLogP value of 1.73814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium. With a topological polar surface area (TPSA) of 46.97 Ų, 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium 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 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium?
The CAS number of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium is 787485-56-7.
What is the molecular formula of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium?
The molecular formula of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium is C15H17N2O+.
What is the molecular weight of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium?
The molecular weight of 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium is 241.13 g/mol.
Where can I buy 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium?
You can request a quote for 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium?
Yes, KEHONG BIO provides custom synthesis services for 5-(Aminocarbonyl)-1-benzyl-2,4-dimethylpyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.