RefChem:439117
TL;DR: RefChem:439117 (CAS 51733-03-0) is a chemical compound with molecular formula C44H56Cl4N10O2Zn-2 and molecular weight 960.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-[2-benzyl-3-[[4-(diethylamino)phenyl]diazenyl]pyrazol-1-ium-1-yl]ethanol);zinc;tetrachloride
Also Known As: C22H28N5O.1/2Cl4Zn, C22-H28-N5-O.1/2Cl4-Zn, 1H-Pyrazolium, 5-((4-(diethylamino)phenyl)azo)-2-(2-hydroxyethyl)-1-(phenylmethyl)-, (T-4)-tetrachlorozincate(2-) (2:1), 1H-Pyrazolium, 5-(2-(4-(diethylamino)phenyl)diazenyl)-2-(2-hydroxyethyl)-1-(phenylmethyl)-, (T-4)-tetrachlorozincate(2-) (2:1), 1H-Pyrazolium, 5-[[4-(diethylamino)phenyl]azo]-2-(2-hydroxyethyl)-1-(phenylmethyl)-, (T-4)-tetrachlorozincate(2-) (2:1)
| Molecular Formula | C44H56Cl4N10O2Zn-2 |
|---|---|
| Molecular Weight | 960.26 g/mol |
| LogP | -3.8309 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 18 |
| Exact Mass | 960.2633 |
| Heavy Atoms | 61 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 51733-03-0 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)N=NC2=CC=[N+](N2CC3=CC=CC=C3)CCO.CCN(CC)C1=CC=C(C=C1)N=NC2=CC=[N+](N2CC3=CC=CC=C3)CCO.[Cl-].[Cl-].[Cl-].[Cl-].[Zn] |
| InChIKey | OSGVKEHUBCEVOX-UHFFFAOYSA-J |
Product Overview
RefChem:439117 (CAS 51733-03-0), with molecular formula C44H56Cl4N10O2Zn-2 and molecular weight 960.26 g/mol. IUPAC: bis(2-[2-benzyl-3-[[4-(diethylamino)phenyl]diazenyl]pyrazol-1-ium-1-yl]ethanol);zinc;tetrachloride.
Chemical Property Profile of RefChem:439117
Property Insights of RefChem:439117
The XLogP value of -3.8309 indicates that RefChem:439117 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:439117. Following Lipinski's Rule of Five, RefChem:439117 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:439117?
The CAS number of RefChem:439117 is 51733-03-0.
What is the molecular formula of RefChem:439117?
The molecular formula of RefChem:439117 is C44H56Cl4N10O2Zn-2.
What is the molecular weight of RefChem:439117?
The molecular weight of RefChem:439117 is 960.26 g/mol.
Where can I buy RefChem:439117?
You can request a quote for RefChem:439117 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:439117?
Yes, KEHONG BIO provides custom synthesis services for RefChem:439117 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.