3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile
TL;DR: 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile (CAS 64071-85-8) is a chemical compound with molecular formula C23H20BrN5O2 and molecular weight 477.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(2-bromo-4-nitrophenyl)diazenyl]-N-(2-phenylethyl)anilino]propanenitrile
Also Known As: 3-((4-(Azo)phenyl) amino)propiononitrile, 3-[[4-[azo]phenyl] amino]propiononitrile, 3-[[4-[ azo]phenyl] amino]propiononitrile, Propanenitrile, 3-((4-((2-bromo-4-nitrophenyl)azo)phenyl)(2-phenylethyl)amino)-, 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile
| Molecular Formula | C23H20BrN5O2 |
|---|---|
| Molecular Weight | 477.08 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 477.08005 |
| Heavy Atoms | 31 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 64071-85-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN(CCC#N)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Br |
| InChIKey | ZAHBEAVYBXUUQZ-UHFFFAOYSA-N |
Product Overview
3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile (CAS 64071-85-8), with molecular formula C23H20BrN5O2 and molecular weight 477.08 g/mol. IUPAC: 3-[4-[(2-bromo-4-nitrophenyl)diazenyl]-N-(2-phenylethyl)anilino]propanenitrile.
Chemical Property Profile of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile
Property Insights of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile
The XLogP value of 6.0 indicates that 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile. Following Lipinski's Rule of Five, 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile?
The CAS number of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile is 64071-85-8.
What is the molecular formula of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile?
The molecular formula of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile is C23H20BrN5O2.
What is the molecular weight of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile?
The molecular weight of 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile is 477.08 g/mol.
Where can I buy 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile?
You can request a quote for 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-((2-Bromo-4-nitrophenyl)diazenyl)-N-(2-phenylethyl)anilino)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.