2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine
TL;DR: 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine (CAS 354537-23-8) is a chemical compound with molecular formula C18H22N2O5 and molecular weight 346.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
Also Known As: BAS 01124668, 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine, 2-(4-nitrophenyl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine, [2-(4-Nitro-phenyl)-ethyl]-(2,3,4-trimethoxy-benzyl)-amine, N-(4-NITROPHENETHYL)-N-(2,3,4-TRIMETHOXYBENZYL)AMINE
| Molecular Formula | C18H22N2O5 |
|---|---|
| Molecular Weight | 346.15 g/mol |
| LogP | 2.9529 |
| Topological Polar Surface Area | 82.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 346.15286 |
| Heavy Atoms | 25 |
| Complexity | 716.1515 |
Chemical Identifiers
| CAS Number | 354537-23-8 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)CNCCC2=CC=C(C=C2)[N+](=O)[O-])OC)OC |
Product Overview
2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine (CAS 354537-23-8), with molecular formula C18H22N2O5 and molecular weight 346.15 g/mol. IUPAC: 2-(4-nitrophenyl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine.
Chemical Property Profile of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine
Property Insights of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine
The XLogP value of 2.9529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine. The TPSA of 82.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine. Following Lipinski's Rule of Five, 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine 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 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
The CAS number of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is 354537-23-8.
What is the molecular formula of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
The molecular formula of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is C18H22N2O5.
What is the molecular weight of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
The molecular weight of 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is 346.15 g/mol.
Where can I buy 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
You can request a quote for 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-nitrophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.