RefChem:869065
TL;DR: RefChem:869065 (CAS 67923-47-1) is a chemical compound with molecular formula C20H21N5O4 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2-cyanoethyl)-4-[(4-nitrophenyl)diazenyl]anilino]ethyl propanoate
Also Known As: Propanenitrile, 3-[[4-[(4-nitrophenyl)azo]phenyl][2-(1-oxopropoxy)ethyl]amino]-, 2-(N-(2-Cyanoethyl)-4-((4-nitrophenyl)azo)anilino)ethyl propionate, 3-(2-(Propionoxy)ethyl(4-((4-nitrophenyl)azo)phenyl)amino)propanenitrile, Propanenitrile, 3-((4-((4-nitrophenyl)azo)phenyl)(2-(1-oxopropoxy)ethyl)amino)-, Propanenitrile, 3-((4-(2-(4-nitrophenyl)diazenyl)phenyl)(2-(1-oxopropoxy)ethyl)amino)-
| Molecular Formula | C20H21N5O4 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 395.15936 |
| Heavy Atoms | 29 |
| Complexity | 596.0 |
Chemical Identifiers
| CAS Number | 67923-47-1 |
|---|---|
| SMILES | CCC(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | FNYGFJSSCAOWLI-UHFFFAOYSA-N |
Product Overview
RefChem:869065 (CAS 67923-47-1), with molecular formula C20H21N5O4 and molecular weight 395.16 g/mol. IUPAC: 2-[N-(2-cyanoethyl)-4-[(4-nitrophenyl)diazenyl]anilino]ethyl propanoate.
Chemical Property Profile of RefChem:869065
Property Insights of RefChem:869065
The XLogP value of 3.7 indicates that RefChem:869065 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:869065. Following Lipinski's Rule of Five, RefChem:869065 has 0 hydrogen bond donor(s) and 8 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 RefChem:869065?
The CAS number of RefChem:869065 is 67923-47-1.
What is the molecular formula of RefChem:869065?
The molecular formula of RefChem:869065 is C20H21N5O4.
What is the molecular weight of RefChem:869065?
The molecular weight of RefChem:869065 is 395.16 g/mol.
Where can I buy RefChem:869065?
You can request a quote for RefChem:869065 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:869065?
Yes, KEHONG BIO provides custom synthesis services for RefChem:869065 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.