3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
TL;DR: 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide (CAS 221875-96-3) is a chemical compound with molecular formula C16H16N2O5 and molecular weight 316.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
Also Known As: 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide, BAS 00784070, N-(2-methyl-5-nitrophenyl)-3,4-dimethoxybenzamide, BIM-0026873.P001, 3,4-Dimethoxy-N-(2-methyl-5-nitro-phenyl)-benzamide
| Molecular Formula | C16H16N2O5 |
|---|---|
| Molecular Weight | 316.11 g/mol |
| LogP | 3.17272 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.10593 |
| Heavy Atoms | 23 |
| Complexity | 758.131 |
Chemical Identifiers
| CAS Number | 221875-96-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)OC)OC |
Product Overview
3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide (CAS 221875-96-3), with molecular formula C16H16N2O5 and molecular weight 316.11 g/mol. IUPAC: 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide.
Chemical Property Profile of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
Property Insights of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide
The XLogP value of 3.17272 indicates that 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 5 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-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
The CAS number of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is 221875-96-3.
What is the molecular formula of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
The molecular formula of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is C16H16N2O5.
What is the molecular weight of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
The molecular weight of 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide is 316.11 g/mol.
Where can I buy 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
You can request a quote for 3,4-dimethoxy-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-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethoxy-N-(2-methyl-5-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.