EINECS 289-278-4
TL;DR: EINECS 289-278-4 (CAS 86772-44-3) is a chemical compound with molecular formula C24H28N8O2 and molecular weight 460.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[N-butyl-4-[[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]diazenyl]-3-methylanilino]butanoate
Also Known As: EINECS 289-278-4, Ethyl 4-(butyl(4-((4,5-dicyano-1-(cyanomethyl)-1H-imidazol-2-yl)azo)-m-tolyl)amino)butyrate, ethyl 4-[N-butyl-4-[[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]diazenyl]-3-methylanilino]butanoate, Ethyl 4-[butyl[4-[[4,5-dicyano-1-(cyanomethyl)-1H-imidazol-2-yl]azo]-3-methylphenyl]amino]butanoate, ethyl4-[butyl[4-[[4,5-dicyano-1- -1H-imidazol-2-yl]azo]-m-tolyl]amino]butyrate
| Molecular Formula | C24H28N8O2 |
|---|---|
| Molecular Weight | 460.23 g/mol |
| LogP | 4.82366 |
| Topological Polar Surface Area | 143.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 460.23352 |
| Heavy Atoms | 34 |
| Complexity | 1147.4337 |
Chemical Identifiers
| CAS Number | 86772-44-3 |
|---|---|
| SMILES | CCCCN(CCCC(=O)OCC)C1=CC(=C(C=C1)N=NC2=NC(=C(N2CC#N)C#N)C#N)C |
Product Overview
EINECS 289-278-4 (CAS 86772-44-3), with molecular formula C24H28N8O2 and molecular weight 460.23 g/mol. IUPAC: ethyl 4-[N-butyl-4-[[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]diazenyl]-3-methylanilino]butanoate.
Chemical Property Profile of EINECS 289-278-4
Property Insights of EINECS 289-278-4
The XLogP value of 4.82366 indicates that EINECS 289-278-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.45 Ų indicates high polarity, suggesting EINECS 289-278-4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 289-278-4 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 EINECS 289-278-4?
The CAS number of EINECS 289-278-4 is 86772-44-3.
What is the molecular formula of EINECS 289-278-4?
The molecular formula of EINECS 289-278-4 is C24H28N8O2.
What is the molecular weight of EINECS 289-278-4?
The molecular weight of EINECS 289-278-4 is 460.23 g/mol.
Where can I buy EINECS 289-278-4?
You can request a quote for EINECS 289-278-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 289-278-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 289-278-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.