3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
TL;DR: 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide (CAS 309951-48-2) is a chemical compound with molecular formula C17H18N2O6 and molecular weight 346.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
Also Known As: 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide, N-(2-methyl-5-nitrophenyl)(3,4,5-trimethoxyphenyl)carboxamide, Cambridge id 5862158
| Molecular Formula | C17H18N2O6 |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.1165 |
| Heavy Atoms | 25 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 309951-48-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
| InChIKey | ZNHYGGIPQWJTIA-UHFFFAOYSA-N |
Product Overview
3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide (CAS 309951-48-2), with molecular formula C17H18N2O6 and molecular weight 346.12 g/mol. IUPAC: 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide.
Chemical Property Profile of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
Property Insights of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 6 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 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
The CAS number of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is 309951-48-2.
What is the molecular formula of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
The molecular formula of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is C17H18N2O6.
What is the molecular weight of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
The molecular weight of 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is 346.12 g/mol.
Where can I buy 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
You can request a quote for 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-trimethoxy-N-(2-methyl-5-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.