2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline
TL;DR: 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline (CAS 353773-20-3) is a chemical compound with molecular formula C17H20N2O6 and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5-nitro-N-[(2,3,4-trimethoxyphenyl)methyl]aniline
Also Known As: 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline, BIM-0048317.P001, 2-methoxy-5-nitro-N-[(2,3,4-trimethoxyphenyl)methyl]aniline
| Molecular Formula | C17H20N2O6 |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 3.2413 |
| Topological Polar Surface Area | 92.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 348.13214 |
| Heavy Atoms | 25 |
| Complexity | 763.0436 |
Chemical Identifiers
| CAS Number | 353773-20-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=C(C(=C(C=C2)OC)OC)OC |
Product Overview
2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline (CAS 353773-20-3), with molecular formula C17H20N2O6 and molecular weight 348.13 g/mol. IUPAC: 2-methoxy-5-nitro-N-[(2,3,4-trimethoxyphenyl)methyl]aniline.
Chemical Property Profile of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline
Property Insights of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline
The XLogP value of 3.2413 indicates that 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline. Following Lipinski's Rule of Five, 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline has 1 hydrogen bond donor(s) and 7 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 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline?
The CAS number of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline is 353773-20-3.
What is the molecular formula of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline?
The molecular formula of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline is C17H20N2O6.
What is the molecular weight of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline?
The molecular weight of 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline is 348.13 g/mol.
Where can I buy 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline?
You can request a quote for 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-methoxy-5-nitro-N-(2,3,4-trimethoxybenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.