![3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium structure](/static/products/1030/1030389-07-1.webp)
3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium
TL;DR: 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium (CAS 1030389-07-1) is a chemical compound with molecular formula C14H14N3O3+ and molecular weight 272.10352 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-methylpyridin-1-ium-1-yl)-N-(3-nitrophenyl)acetamide
Also Known As: BAS 01248429, 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium, 2-(3-methylpyridyl)-N-(3-nitrophenyl)acetamide, 3-methyl-1-[2-(3-nitroanilino)-2-oxoethyl]pyridinium, 2-(3-methylpyridin-1-ium-1-yl)-N-(3-nitrophenyl)acetamide
Technical Specifications
| Molecular Formula | C14H14N3O3+ |
| Molecular Weight | 272.10352 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.10352 Da |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
| SMILES | CC1=C[N+](=CC=C1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | PVZCMJRZQDPELP-UHFFFAOYSA-O |
Chemical Property Profile of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium
Property Insights of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium. Following Lipinski's Rule of Five, 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-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
What is the CAS number of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
The CAS number of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium is 1030389-07-1.
What is the molecular formula of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
The molecular formula of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium is C14H14N3O3+.
What is the molecular weight of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
The molecular weight of 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium is 272.10352 g/mol.
Where can I buy 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
You can request a quote for 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium?
Yes, CoreyChem provides custom synthesis services for 3-Methyl-1-[(3-nitro-phenylcarbamoyl)-methyl]-pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.