3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide
TL;DR: 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide (CAS 312741-90-5) is a chemical compound with molecular formula C18H15N3O3 and molecular weight 321.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide
Also Known As: 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide, 4-nitro-3-methyl-N-(2-methyl-4-quinolinyl)benzamide, AH-034/33702035
| Molecular Formula | C18H15N3O3 |
|---|---|
| Molecular Weight | 321.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 87.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.11133 |
| Heavy Atoms | 24 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 312741-90-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)NC2=CC(=NC3=CC=CC=C32)C)[N+](=O)[O-] |
| InChIKey | DAQLGYRRZRBWQP-UHFFFAOYSA-N |
Product Overview
3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide (CAS 312741-90-5), with molecular formula C18H15N3O3 and molecular weight 321.11 g/mol. IUPAC: 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide.
Chemical Property Profile of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide
Property Insights of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide
The XLogP value of 3.6 indicates that 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 3-methyl-N-(2-methylquinolin-4-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-(2-methylquinolin-4-yl)-4-nitrobenzamide?
The CAS number of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide is 312741-90-5.
What is the molecular formula of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide?
The molecular formula of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide is C18H15N3O3.
What is the molecular weight of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide?
The molecular weight of 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide is 321.11 g/mol.
Where can I buy 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide?
You can request a quote for 3-methyl-N-(2-methylquinolin-4-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-(2-methylquinolin-4-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-(2-methylquinolin-4-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.