Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium
TL;DR: Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium (CAS 72152-47-7) is a chemical compound with molecular formula C20H9Cl3CuN7Na3O11S3 and molecular weight 855.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper;trisodium;2-[3-methyl-5-oxido-4-[[2-oxido-5-sulfonato-3-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]pyrazol-1-yl]benzene-1,4-disulfonate
Also Known As: Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium, Cuprate(3-), (2-(4,5-dihydro-4-(2-(2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)diazenyl-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, sodium (1:3), Cuprate(3-), [2-[4,5-dihydro-4-[[2-(hydroxy-.kappa.O)-5-sulfo-3-[(2,5,6-trichloro-4-pyrimidinyl)amino]phenyl]azo-.kappa.N1]-3-methyl-5-(oxo-.kappa.O)-1H-pyrazol-1-yl]-1,4-benzenedisulfonato(5-)]-, trisodium, copper trisodium 2-[3-methyl-5-oxido-4-[[2-oxido-5-sulfonato-3-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]pyrazol-1-yl]benzene-1,4-disulfonate, Cuprate(3-), [2-[4,5-dihydro-4-[[2-hydroxy-5-sulfo-3-[(2,5,6-trichloro-4-pyrimidinyl)amino]phenyl]azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]-1,4-benzenedisulfonato(5-)]-, trisodium
| Molecular Formula | C20H9Cl3CuN7Na3O11S3 |
|---|---|
| Molecular Weight | 855.76 g/mol |
| LogP | -7.04108 |
| Topological Polar Surface Area | 323.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 5 |
| Exact Mass | 855.7577 |
| Heavy Atoms | 48 |
| Complexity | 1340.0 |
Chemical Identifiers
| CAS Number | 72152-47-7 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])NC3=C(C(=NC(=N3)Cl)Cl)Cl)S(=O)(=O)[O-])[O-])C4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2] |
| InChIKey | ZMHNCMDBSQPQPP-UHFFFAOYSA-I |
Product Overview
Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium (CAS 72152-47-7), with molecular formula C20H9Cl3CuN7Na3O11S3 and molecular weight 855.76 g/mol. IUPAC: copper;trisodium;2-[3-methyl-5-oxido-4-[[2-oxido-5-sulfonato-3-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]pyrazol-1-yl]benzene-1,4-disulfonate.
Chemical Property Profile of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium
Property Insights of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium
The XLogP value of -7.04108 indicates that Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 323.0 Ų indicates high polarity, suggesting Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium has 1 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium?
The CAS number of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium is 72152-47-7.
What is the molecular formula of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium?
The molecular formula of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium is C20H9Cl3CuN7Na3O11S3.
What is the molecular weight of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium?
The molecular weight of Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium is 855.76 g/mol.
Where can I buy Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium?
You can request a quote for Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium?
Yes, KEHONG BIO provides custom synthesis services for Cuprate(3-), (2-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-sulfo-3-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)-1,4-benzenedisulfonato(5-))-, trisodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.