![4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline structure](/static/products/4782/478259-77-7.webp)
4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline
TL;DR: 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline (CAS 478259-77-7) is a chemical compound with molecular formula C14H12Cl2N2O3 and molecular weight 326.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline
Also Known As: 4-chloro-N-(3-chloro-4-methoxybenzyl)-2-nitroaniline, 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline, 8R-0340, 4-chloro-N-[(3-chloro-4-methoxy-phenyl)methyl]-2-nitro-aniline
| Molecular Formula | C14H12Cl2N2O3 |
|---|---|
| Molecular Weight | 326.02 g/mol |
| LogP | 4.5223 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.0225 |
| Heavy Atoms | 21 |
| Complexity | 677.26385 |
Chemical Identifiers
| CAS Number | 478259-77-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)Cl)[N+](=O)[O-])Cl |
Product Overview
4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline (CAS 478259-77-7), with molecular formula C14H12Cl2N2O3 and molecular weight 326.02 g/mol. IUPAC: 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline.
Chemical Property Profile of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline
Property Insights of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline
The XLogP value of 4.5223 indicates that 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline. Following Lipinski's Rule of Five, 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline has 1 hydrogen bond donor(s) and 4 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 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline?
The CAS number of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline is 478259-77-7.
What is the molecular formula of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline?
The molecular formula of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline is C14H12Cl2N2O3.
What is the molecular weight of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline?
The molecular weight of 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline is 326.02 g/mol.
Where can I buy 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline?
You can request a quote for 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.