![4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline structure](/static/products/303/303216-07-1.png)
4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline
TL;DR: 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline (CAS 303216-07-1) is a chemical compound with molecular formula C17H18ClN3O2 and molecular weight 331.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chloro-3-nitrophenyl)iminomethyl]-N,N-diethylaniline
Also Known As: BAS 00548830, 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline, (4-chloro-3-nitrophenyl)[4-(diethylamino)benzylidene]amine, 4-[(4-chloro-3-nitrophenyl)iminomethyl]-N,N-diethylaniline, (4-Chloro-3-nitro-phenyl)-(4-diethylamino-benzylidene)-amine
| Molecular Formula | C17H18ClN3O2 |
|---|---|
| Molecular Weight | 331.11 g/mol |
| LogP | 4.845 |
| Topological Polar Surface Area | 58.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.10876 |
| Heavy Atoms | 23 |
| Complexity | 710.27844 |
Chemical Identifiers
| CAS Number | 303216-07-1 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C=NC2=CC(=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline (CAS 303216-07-1), with molecular formula C17H18ClN3O2 and molecular weight 331.11 g/mol. IUPAC: 4-[(4-chloro-3-nitrophenyl)iminomethyl]-N,N-diethylaniline.
Chemical Property Profile of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline
Property Insights of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline
The XLogP value of 4.845 indicates that 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.74 Ų, 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline has 0 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-[4-(diethylamino)benzylidene]-3-nitroaniline?
The CAS number of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline is 303216-07-1.
What is the molecular formula of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline?
The molecular formula of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline is C17H18ClN3O2.
What is the molecular weight of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline?
The molecular weight of 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline is 331.11 g/mol.
Where can I buy 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline?
You can request a quote for 4-chloro-N-[4-(diethylamino)benzylidene]-3-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-[4-(diethylamino)benzylidene]-3-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[4-(diethylamino)benzylidene]-3-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.