EINECS 243-542-5
TL;DR: EINECS 243-542-5 (CAS 20139-62-2) is a chemical compound with molecular formula C34H30Cl2N6O6 and molecular weight 688.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-chloro-4-[2-chloro-4-[[1-(4-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(4-methoxyphenyl)-3-oxobutanamide
Also Known As: 2,2'-[ bis ]bis[N- -3-oxobutyramide], 2,2'-((2,2'-Dichloro(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(N-(4-methoxyphenyl)-3-oxobutyramide), 2,2'-[(2,2'-DICHLORO[1,1'-BIPHENYL]-4,4'-DIYL)BIS(AZO)]BIS[N-(4-METHOXYPHENYL)-3-OXOBUTYRAMIDE], 2,2'-[(2,2'-dichlorobiphenyl-4,4'-diyl)di(e)diazene-2,1-diyl]bis[n-(4-methoxyphenyl)-3-oxobutanamide], 2,2 -[(2,2 -Dichloro-1,1 -biphenyl-4,4 -diyl)bis(azo)]bis[N-(4-methoxyphenyl)-3-oxobutanamide]
| Molecular Formula | C34H30Cl2N6O6 |
|---|---|
| Molecular Weight | 688.16 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 688.1604 |
| Heavy Atoms | 48 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 20139-62-2 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=CC=C(C=C1)OC)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=C(C=C4)OC)Cl)Cl |
| InChIKey | JFXMNXSPYGVWSS-UHFFFAOYSA-N |
Product Overview
EINECS 243-542-5 (CAS 20139-62-2), with molecular formula C34H30Cl2N6O6 and molecular weight 688.16 g/mol. IUPAC: 2-[[3-chloro-4-[2-chloro-4-[[1-(4-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(4-methoxyphenyl)-3-oxobutanamide.
Chemical Property Profile of EINECS 243-542-5
Property Insights of EINECS 243-542-5
The XLogP value of 8.0 indicates that EINECS 243-542-5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.0 Ų indicates high polarity, suggesting EINECS 243-542-5 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 243-542-5 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 243-542-5?
The CAS number of EINECS 243-542-5 is 20139-62-2.
What is the molecular formula of EINECS 243-542-5?
The molecular formula of EINECS 243-542-5 is C34H30Cl2N6O6.
What is the molecular weight of EINECS 243-542-5?
The molecular weight of EINECS 243-542-5 is 688.16 g/mol.
Where can I buy EINECS 243-542-5?
You can request a quote for EINECS 243-542-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 243-542-5?
Yes, KEHONG BIO provides custom synthesis services for EINECS 243-542-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.