![1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium structure](/static/products/1030/1030389-91-3.webp)
1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium
TL;DR: 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium (CAS 1030389-91-3) is a chemical compound with molecular formula C14H13ClN3O3+ and molecular weight 306.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-4-nitrophenyl)-2-(2-methylpyridin-1-ium-1-yl)acetamide
Also Known As: BAS 01248457, 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium, 1-[2-(2-chloro-4-nitroanilino)-2-oxoethyl]-2-methylpyridinium, N-(2-chloro-4-nitrophenyl)-2-(2-methylpyridin-1-ium-1-yl)acetamide, N-(2-chloro-4-nitrophenyl)-2-(2-methylpyridyl)acetamide
| Molecular Formula | C14H13ClN3O3+ |
|---|---|
| Molecular Weight | 306.06 g/mol |
| LogP | 2.48282 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.06454 |
| Heavy Atoms | 21 |
| Complexity | 703.61365 |
Chemical Identifiers
| CAS Number | 1030389-91-3 |
|---|---|
| SMILES | CC1=CC=CC=[N+]1CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl |
Product Overview
1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium (CAS 1030389-91-3), with molecular formula C14H13ClN3O3+ and molecular weight 306.06 g/mol. IUPAC: N-(2-chloro-4-nitrophenyl)-2-(2-methylpyridin-1-ium-1-yl)acetamide.
Chemical Property Profile of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium
Property Insights of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium
The XLogP value of 2.48282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium. The TPSA of 76.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium. Following Lipinski's Rule of Five, 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium 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 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium?
The CAS number of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium is 1030389-91-3.
What is the molecular formula of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium?
The molecular formula of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium is C14H13ClN3O3+.
What is the molecular weight of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium?
The molecular weight of 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium is 306.06 g/mol.
Where can I buy 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium?
You can request a quote for 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-2-methyl-pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.