![4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium structure](/static/products/1022/1022902-47-1.webp)
4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium
TL;DR: 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium (CAS 1022902-47-1) is a chemical compound with molecular formula C15H17N4O3+ and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide
Also Known As: BAS 01213409, 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium, 4-(dimethylamino)-1-[2-(3-nitroanilino)-2-oxoethyl]pyridinium, 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide
| Molecular Formula | C15H17N4O3+ |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 1.587 |
| Topological Polar Surface Area | 79.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.13007 |
| Heavy Atoms | 22 |
| Complexity | 683.44183 |
Chemical Identifiers
| CAS Number | 1022902-47-1 |
|---|---|
| SMILES | CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium (CAS 1022902-47-1), with molecular formula C15H17N4O3+ and molecular weight 301.13 g/mol. IUPAC: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium
Property Insights of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium
The XLogP value of 1.587 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium. The TPSA of 79.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium. Following Lipinski's Rule of Five, 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium has 1 hydrogen bond donor(s) and 4 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 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
The CAS number of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium is 1022902-47-1.
What is the molecular formula of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
The molecular formula of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium is C15H17N4O3+.
What is the molecular weight of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
The molecular weight of 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium is 301.13 g/mol.
Where can I buy 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
You can request a quote for 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
Yes, KEHONG BIO provides custom synthesis services for 4-Dimethylamino-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.