N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine
TL;DR: N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine (CAS 5235-69-8) is a chemical compound with molecular formula C16H19N3O2 and molecular weight 285.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,4-N-diethyl-1-N-(4-nitrophenyl)benzene-1,4-diamine
Also Known As: N,N-diethyl-N'-(4-nitrophenyl)benzene-1,4-diamine, N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine, 1,4-benzenediamine, N1,N1-diethyl-N4-(4-nitrophenyl)-, 4-N,4-N-diethyl-1-N-(4-nitrophenyl)benzene-1,4-diamine, N~1~,N~1~-Diethyl-N~4~-(4-nitrophenyl)benzene-1,4-diamine
| Molecular Formula | C16H19N3O2 |
|---|---|
| Molecular Weight | 285.15 g/mol |
| LogP | 4.1846 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.14774 |
| Heavy Atoms | 21 |
| Complexity | 589.9241 |
Chemical Identifiers
| CAS Number | 5235-69-8 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine (CAS 5235-69-8), with molecular formula C16H19N3O2 and molecular weight 285.15 g/mol. IUPAC: 4-N,4-N-diethyl-1-N-(4-nitrophenyl)benzene-1,4-diamine.
Chemical Property Profile of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine
Property Insights of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine
The XLogP value of 4.1846 indicates that N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.41 Ų, N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine 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 N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine?
The CAS number of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine is 5235-69-8.
What is the molecular formula of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine?
The molecular formula of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine is C16H19N3O2.
What is the molecular weight of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine?
The molecular weight of N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine is 285.15 g/mol.
Where can I buy N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine?
You can request a quote for N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine?
Yes, KEHONG BIO provides custom synthesis services for N1,N1-Diethyl-N4-(4-nitrophenyl)-1,4-benzenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.