RefChem:591974
TL;DR: RefChem:591974 (CAS 26841-47-4) is a chemical compound with molecular formula C36H31N5O4 and molecular weight 597.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2-benzoyloxyethyl)-4-[(4-phenyldiazenylphenyl)diazenyl]anilino]ethyl benzoate
Also Known As: Ethanol, 2,2'-((4-((4-(phenylazo)phenyl)azo)phenyl)imino)bis-, dibenzoate (ester), Ethanol, 2,2'-((4-(2-(4-(2-phenyldiazenyl)phenyl)diazenyl)phenyl)imino)bis-, 1,1'-dibenzoate, Ethanol, 2,2'-[[4-[[4-(phenylazo)phenyl]azo]phenyl]imino]bis-, dibenzoate (ester), ethanol, 2,2'-((4-((4-(phenylazo)phenyl)azo)phenyl)imino)bis-, dibenzoate(ester), 2,2 -[[4-[[4-(Phenylazo)phenyl]azo]phenyl]imino]bisethanol dibenzoate
| Molecular Formula | C36H31N5O4 |
|---|---|
| Molecular Weight | 597.24 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 597.2376 |
| Heavy Atoms | 45 |
| Complexity | 890.0 |
Chemical Identifiers
| CAS Number | 26841-47-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCCN(CCOC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)N=NC5=CC=CC=C5 |
| InChIKey | ZRTJIQWDXZGSCW-UHFFFAOYSA-N |
Product Overview
RefChem:591974 (CAS 26841-47-4), with molecular formula C36H31N5O4 and molecular weight 597.24 g/mol. IUPAC: 2-[N-(2-benzoyloxyethyl)-4-[(4-phenyldiazenylphenyl)diazenyl]anilino]ethyl benzoate.
Chemical Property Profile of RefChem:591974
Property Insights of RefChem:591974
The XLogP value of 8.7 indicates that RefChem:591974 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:591974. Following Lipinski's Rule of Five, RefChem:591974 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:591974?
The CAS number of RefChem:591974 is 26841-47-4.
What is the molecular formula of RefChem:591974?
The molecular formula of RefChem:591974 is C36H31N5O4.
What is the molecular weight of RefChem:591974?
The molecular weight of RefChem:591974 is 597.24 g/mol.
Where can I buy RefChem:591974?
You can request a quote for RefChem:591974 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:591974?
Yes, KEHONG BIO provides custom synthesis services for RefChem:591974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.