Einecs 267-235-0
TL;DR: Einecs 267-235-0 (CAS 67827-86-5) is a chemical compound with molecular formula C39H45N11O7 and molecular weight 779.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[1-[2-methoxy-5-(methylamino)anilino]-1,3-dioxobutan-2-yl]diazenyl]-N-[4-[[1-[2-methoxy-5-(methylamino)anilino]-1,3-dioxobutan-2-yl]diazenyl]-2-(methylamino)phenyl]-5-(methylamino)benzamide
Also Known As: 1,4,5,8-tetrakis{[3-(dimethylamino)propyl]amino}-9,10-anthraquinone, 3-[[1-[2-methoxy-5-(methylamino)anilino]-1,3-dioxobutan-2-yl]diazenyl]-N-[4-[[1-[2-methoxy-5-(methylamino)anilino]-1,3-dioxobutan-2-yl]diazenyl]-2-(methylamino)phenyl]-5-(methylamino)benzamide, Benzamide, 4-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)-N-(4-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)-, tetrakis(aminomethyl) deriv., Benzamide, 4-(2-(1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)diazenyl)-N-(4-(2-(1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)diazenyl)phenyl)-, tetrakis(aminomethyl) deriv., Benzamide, 4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-N-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]-, tetrakis(aminomethyl) deriv.
| Molecular Formula | C39H45N11O7 |
|---|---|
| Molecular Weight | 779.35 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 237.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 18 |
| Exact Mass | 779.35034 |
| Heavy Atoms | 57 |
| Complexity | 1420.0 |
Chemical Identifiers
| CAS Number | 67827-86-5 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=C(C=CC(=C1)NC)OC)N=NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC(=C3)N=NC(C(=O)C)C(=O)NC4=C(C=CC(=C4)NC)OC)NC)NC |
| InChIKey | CBQTXCDXHLFVGL-UHFFFAOYSA-N |
Product Overview
Einecs 267-235-0 (CAS 67827-86-5), with molecular formula C39H45N11O7 and molecular weight 779.35 g/mol. IUPAC: 3-[[1-[2-methoxy-5-(methylamino)anilino]-1,3-dioxobutan-2-yl]diazenyl]-N-[4-[[1-[2-methoxy-5-(methylamino)anilino]-1,3-dioxobutan-2-yl]diazenyl]-2-(methylamino)phenyl]-5-(methylamino)benzamide.
Chemical Property Profile of Einecs 267-235-0
Property Insights of Einecs 267-235-0
The XLogP value of 5.9 indicates that Einecs 267-235-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 237.0 Ų indicates high polarity, suggesting Einecs 267-235-0 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 267-235-0 has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 267-235-0?
The CAS number of Einecs 267-235-0 is 67827-86-5.
What is the molecular formula of Einecs 267-235-0?
The molecular formula of Einecs 267-235-0 is C39H45N11O7.
What is the molecular weight of Einecs 267-235-0?
The molecular weight of Einecs 267-235-0 is 779.35 g/mol.
Where can I buy Einecs 267-235-0?
You can request a quote for Einecs 267-235-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 267-235-0?
Yes, KEHONG BIO provides custom synthesis services for Einecs 267-235-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.