3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide
TL;DR: 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide (CAS 313552-78-2) is a chemical compound with molecular formula C14H13N3O3 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-(4-methyl-2-pyridinyl)-4-nitrobenzamide
Also Known As: BAS 01145287, 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide, 3-Methyl-N-(4-methyl-2-pyridinyl)-4-nitrobenzamide #, 3-Methyl-N-(4-methyl-pyridin-2-yl)-4-nitro-benzamide, Benzamide, 3-methyl-4-nitro-N-(4-methyl-2-pyridyl)-
| Molecular Formula | C14H13N3O3 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 87.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.0957 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 313552-78-2 |
|---|---|
| SMILES | CC1=CC(=NC=C1)NC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C |
| InChIKey | AVFKHTDVYYICPL-UHFFFAOYSA-N |
Product Overview
3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide (CAS 313552-78-2), with molecular formula C14H13N3O3 and molecular weight 271.10 g/mol. IUPAC: 3-methyl-N-(4-methyl-2-pyridinyl)-4-nitrobenzamide.
Chemical Property Profile of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide
Property Insights of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide. The TPSA of 87.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide 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 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide?
The CAS number of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide is 313552-78-2.
What is the molecular formula of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide?
The molecular formula of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide is C14H13N3O3.
What is the molecular weight of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide?
The molecular weight of 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide is 271.10 g/mol.
Where can I buy 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide?
You can request a quote for 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-(4-methylpyridin-2-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.