N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
TL;DR: N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide (CAS 722453-19-2) is a chemical compound with molecular formula C16H18N3O3+ and molecular weight 300.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
Also Known As: BAS 01248461, 3-Methyl-1-[1-(4-methyl-3-nitro-phenylcarbamoyl)-ethyl]-pyridinium, N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
| Molecular Formula | C16H18N3O3+ |
|---|---|
| Molecular Weight | 300.13 g/mol |
| LogP | 2.69884 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.13483 |
| Heavy Atoms | 22 |
| Complexity | 728.326 |
Chemical Identifiers
| CAS Number | 722453-19-2 |
|---|---|
| SMILES | CC1=C[N+](=CC=C1)C(C)C(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-] |
Product Overview
N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide (CAS 722453-19-2), with molecular formula C16H18N3O3+ and molecular weight 300.13 g/mol. IUPAC: N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide.
Chemical Property Profile of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
Property Insights of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
The XLogP value of 2.69884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide. The TPSA of 76.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide. Following Lipinski's Rule of Five, N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide 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-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide?
The CAS number of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide is 722453-19-2.
What is the molecular formula of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide?
The molecular formula of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide is C16H18N3O3+.
What is the molecular weight of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide?
The molecular weight of N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide is 300.13 g/mol.
Where can I buy N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide?
You can request a quote for N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.