RefChem:869295
TL;DR: RefChem:869295 (CAS 73309-52-1) is a chemical compound with molecular formula C22H22N6O4 and molecular weight 434.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2-cyanoethyl)-4-[(2-cyano-4-nitrophenyl)diazenyl]anilino]ethyl 2-methylpropanoate
Also Known As: Propanoic acid, 2-methyl-, 2-[(2-cyanoethyl)[4-[(2-cyano-4-nitrophenyl)azo]phenyl]amino]ethyl ester, Propanoic acid, 2-methyl-, 2-((2-cyanoethyl)(4-((2-cyano-4-nitrophenyl)azo)phenyl)amino)ethyl ester, Propanoic acid, 2-methyl-, 2-((2-cyanoethyl)(4-(2-(2-cyano-4-nitrophenyl)diazenyl)phenyl)amino)ethyl ester, 2-((2-Cyanoethyl)(4-((2-cyano-4-nitrophenyl)azo)phenyl)amino)ethylisobutyrate, 2-[(2-CYANOETHYL)[4-[(2-CYANO-4-NITROPHENYL)AZO]PHENYL]AMINO]ETHYL ISOBUTYRATE
| Molecular Formula | C22H22N6O4 |
|---|---|
| Molecular Weight | 434.17 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 434.17026 |
| Heavy Atoms | 32 |
| Complexity | 753.0 |
Chemical Identifiers
| CAS Number | 73309-52-1 |
|---|---|
| SMILES | CC(C)C(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N |
| InChIKey | GNYGWUKVNULGTI-UHFFFAOYSA-N |
Product Overview
RefChem:869295 (CAS 73309-52-1), with molecular formula C22H22N6O4 and molecular weight 434.17 g/mol. IUPAC: 2-[N-(2-cyanoethyl)-4-[(2-cyano-4-nitrophenyl)diazenyl]anilino]ethyl 2-methylpropanoate.
Chemical Property Profile of RefChem:869295
Property Insights of RefChem:869295
The XLogP value of 4.0 indicates that RefChem:869295 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.0 Ų indicates high polarity, suggesting RefChem:869295 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:869295 has 0 hydrogen bond donor(s) and 9 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:869295?
The CAS number of RefChem:869295 is 73309-52-1.
What is the molecular formula of RefChem:869295?
The molecular formula of RefChem:869295 is C22H22N6O4.
What is the molecular weight of RefChem:869295?
The molecular weight of RefChem:869295 is 434.17 g/mol.
Where can I buy RefChem:869295?
You can request a quote for RefChem:869295 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:869295?
Yes, KEHONG BIO provides custom synthesis services for RefChem:869295 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.