RefChem:868752
TL;DR: RefChem:868752 (CAS 66693-27-4) is a chemical compound with molecular formula C21H22ClN7O7 and molecular weight 519.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-chloro-4,6-dinitrophenyl)diazenyl]-5-[2-(2-cyanoethoxy)ethylamino]-4-methoxyphenyl]propanamide
Also Known As: N-(2-((2-Chloro-4,6-dinitrophenyl)azo)-5-((2-(2-cyanoethoxy)ethyl)amino)-4-methoxyphenyl)propanamide, Propanamide, N-[2-[(2-chloro-4,6-dinitrophenyl)azo]-5-[[2-(2-cyanoethoxy)ethyl]amino]-4-methoxyphenyl]-, N-[2-[(2-chloro-4,6-dinitrophenyl)diazenyl]-5-[2-(2-cyanoethoxy)ethylamino]-4-methoxyphenyl]propanamide, N-2-(2-Chloro-4,6-dinitrophenyl)azo-5-2-(2-cyanoethoxy)ethylamino-4-methoxyphenylpropionamide, Propanamide, N-(2-((2-chloro-4,6-dinitrophenyl)azo)-5-((2-(2-cyanoethoxy)ethyl)amino)-4-methoxyphenyl)-
| Molecular Formula | C21H22ClN7O7 |
|---|---|
| Molecular Weight | 519.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 519.12695 |
| Heavy Atoms | 36 |
| Complexity | 828.0 |
Chemical Identifiers
| CAS Number | 66693-27-4 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-])OC)NCCOCCC#N |
| InChIKey | BTZJHLSNGVJBBH-UHFFFAOYSA-N |
Product Overview
RefChem:868752 (CAS 66693-27-4), with molecular formula C21H22ClN7O7 and molecular weight 519.13 g/mol. IUPAC: N-[2-[(2-chloro-4,6-dinitrophenyl)diazenyl]-5-[2-(2-cyanoethoxy)ethylamino]-4-methoxyphenyl]propanamide.
Chemical Property Profile of RefChem:868752
Property Insights of RefChem:868752
The XLogP value of 3.1 indicates that RefChem:868752 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 200.0 Ų indicates high polarity, suggesting RefChem:868752 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:868752 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:868752?
The CAS number of RefChem:868752 is 66693-27-4.
What is the molecular formula of RefChem:868752?
The molecular formula of RefChem:868752 is C21H22ClN7O7.
What is the molecular weight of RefChem:868752?
The molecular weight of RefChem:868752 is 519.13 g/mol.
Where can I buy RefChem:868752?
You can request a quote for RefChem:868752 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:868752?
Yes, KEHONG BIO provides custom synthesis services for RefChem:868752 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.