2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline
TL;DR: 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline (CAS 423733-04-4) is a chemical compound with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline
Also Known As: 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline, N-[3-(benzyloxy)-4-methoxybenzyl]-2-methoxy-5-nitroaniline, N-[3-(BENZYLOXY)-4-METHOXYBENZYL]-N-(2-METHOXY-5-NITROPHENYL)AMINE, N-{[3-(BENZYLOXY)-4-METHOXYPHENYL]METHYL}-2-METHOXY-5-NITROANILINE
| Molecular Formula | C22H22N2O5 |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 4.8031 |
| Topological Polar Surface Area | 82.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 394.15286 |
| Heavy Atoms | 29 |
| Complexity | 976.1916 |
Chemical Identifiers
| CAS Number | 423733-04-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3 |
Product Overview
2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline (CAS 423733-04-4), with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol. IUPAC: 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline.
Chemical Property Profile of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline
Property Insights of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline
The XLogP value of 4.8031 indicates that 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline. Following Lipinski's Rule of Five, 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline 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-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline?
The CAS number of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline is 423733-04-4.
What is the molecular formula of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline?
The molecular formula of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline is C22H22N2O5.
What is the molecular weight of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline?
The molecular weight of 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline is 394.15 g/mol.
Where can I buy 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline?
You can request a quote for 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-methoxy-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.