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N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline
TL;DR: N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline (CAS 1773-47-3) is a chemical compound with molecular formula C13H9ClN4O4 and molecular weight 320.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline
Also Known As: N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline, N-[(4-chlorophenyl)methylideneamino]-2,4-dinitro-aniline, N-[(E)-(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline
| Molecular Formula | C13H9ClN4O4 |
|---|---|
| Molecular Weight | 320.03 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.03122 |
| Heavy Atoms | 22 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 1773-47-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Cl |
| InChIKey | HNRHTYXBELCYRG-UHFFFAOYSA-N |
Product Overview
N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline (CAS 1773-47-3), with molecular formula C13H9ClN4O4 and molecular weight 320.03 g/mol. IUPAC: N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline.
Chemical Property Profile of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline
Property Insights of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline
The XLogP value of 3.1 indicates that N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline. Following Lipinski's Rule of Five, N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline 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 N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline?
The CAS number of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline is 1773-47-3.
What is the molecular formula of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline?
The molecular formula of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline is C13H9ClN4O4.
What is the molecular weight of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline?
The molecular weight of N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline is 320.03 g/mol.
Where can I buy N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline?
You can request a quote for N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-chlorophenyl)methylideneamino]-2,4-dinitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.