Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-
TL;DR: Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- (CAS 53493-60-0) is a chemical compound with molecular formula C17H20N2O5 and molecular weight 332.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]-2-nitroaniline
Also Known As: Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-, 4,5-dimethoxy-n-[2-(4-methoxyphenyl)ethyl]-2-nitroaniline, N-(4,5-Dimethoxy-2-nitrophenyl)-4-methoxybenzeneethanamine, BRN 3068475, RefChem:324643
| Molecular Formula | C17H20N2O5 |
|---|---|
| Molecular Weight | 332.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 85.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 332.1372 |
| Heavy Atoms | 24 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 53493-60-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CCNC2=CC(=C(C=C2[N+](=O)[O-])OC)OC |
| InChIKey | ULAXHIHELRVYBO-UHFFFAOYSA-N |
Product Overview
Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- (CAS 53493-60-0), with molecular formula C17H20N2O5 and molecular weight 332.14 g/mol. IUPAC: 4,5-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]-2-nitroaniline.
Chemical Property Profile of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-
Property Insights of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-
The XLogP value of 4.2 indicates that Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-. Following Lipinski's Rule of Five, Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- 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 Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-?
The CAS number of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- is 53493-60-0.
What is the molecular formula of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-?
The molecular formula of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- is C17H20N2O5.
What is the molecular weight of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-?
The molecular weight of Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- is 332.14 g/mol.
Where can I buy Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-?
You can request a quote for Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-4-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.