N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine
TL;DR: N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine (CAS 893581-71-0) is a chemical compound with molecular formula C20H24ClN3O4 and molecular weight 405.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-chloro-4-nitrophenyl)-N-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]ethane-1,2-diamine
Also Known As: N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine, N'-(2-chloro-4-nitro-phenyl)-N-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]ethane-1,2-diamine, N'-(2-chloro-4-nitrophenyl)-N-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]ethane-1,2-diamine, N~1~-(2-Chloro-4-nitrophenyl)-N~2~-({3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methyl)ethane-1,2-diamine
| Molecular Formula | C20H24ClN3O4 |
|---|---|
| Molecular Weight | 405.15 g/mol |
| LogP | 4.4134 |
| Topological Polar Surface Area | 85.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 405.14554 |
| Heavy Atoms | 28 |
| Complexity | 814.03296 |
Chemical Identifiers
| CAS Number | 893581-71-0 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)OCC=C |
Product Overview
N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine (CAS 893581-71-0), with molecular formula C20H24ClN3O4 and molecular weight 405.15 g/mol. IUPAC: N'-(2-chloro-4-nitrophenyl)-N-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]ethane-1,2-diamine.
Chemical Property Profile of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine
Property Insights of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine
The XLogP value of 4.4134 indicates that N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine. Following Lipinski's Rule of Five, N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine has 2 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 N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine?
The CAS number of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine is 893581-71-0.
What is the molecular formula of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine?
The molecular formula of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine is C20H24ClN3O4.
What is the molecular weight of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine?
The molecular weight of N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine is 405.15 g/mol.
Where can I buy N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine?
You can request a quote for N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine?
Yes, KEHONG BIO provides custom synthesis services for N1-(2-Chloro-4-nitrophenyl)-N2-[[3-ethoxy-4-(2-propen-1-yloxy)phenyl]methyl]-1,2-ethanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.