Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)
TL;DR: Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) (CAS 72928-86-0) is a chemical compound with molecular formula C42H45CrN12O12S2 and molecular weight 1025.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
chromium(3+);3-[4-[[3-(2,2-dimethylpropyl)-5-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide;4-[[5-(2,2-dimethylpropyl)-3-nitro-2-oxidophenyl]diazenyl]-3-methyl-1-(3-sulfamoylphenyl)pyrazol-5-olate;hydron
Also Known As: Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1), Chromate(1-), bis(2,4-dihydro-4-((2-hydroxy-5-(2,2-dimethylpropyl)-3-nitrophenyl)azo)-5-methyl-2-(3-(aminosulfonyl)phenyl)-3H-pyrazol-3-onato(2-))-, hydrogen, Chromate(1-), bis(3-(4-((5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)azo-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen, Chromate(1-), bis[3-[4-[[5-(2,2-dimethylpropyl)-2-(hydroxy-.kappa.O)-3-nitrophenyl]azo-.kappa.N1]-4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1H-pyrazol-1-yl]benzenesulfonamidato(2-)]-, hydrogen, Chromate(1-), bis[3-[4-[[5-(2,2-dimethylpropyl)-2-hydroxy-3-nitrophenyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonamidato(2-)]-, hydrogen
| Molecular Formula | C42H45CrN12O12S2 |
|---|---|
| Molecular Weight | 1025.21 g/mol |
| LogP | 4.97782 |
| Topological Polar Surface Area | 395.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 11 |
| Exact Mass | 1025.2126 |
| Heavy Atoms | 69 |
| Complexity | 853.0 |
Chemical Identifiers
| CAS Number | 72928-86-0 |
|---|---|
| SMILES | [H+].CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)CC(C)(C)C)[N+](=O)[O-])[O-])[O-])C3=CC(=CC=C3)S(=O)(=O)N.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)N([O-])[O-])CC(C)(C)C)C3=CC(=CC=C3)S(=O)(=O)N.[Cr+3] |
| InChIKey | HHZLOPNARYXUMA-UHFFFAOYSA-M |
Product Overview
Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) (CAS 72928-86-0), with molecular formula C42H45CrN12O12S2 and molecular weight 1025.21 g/mol. IUPAC: chromium(3+);3-[4-[[3-(2,2-dimethylpropyl)-5-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide;4-[[5-(2,2-dimethylpropyl)-3-nitro-2-oxidophenyl]diazenyl]-3-methyl-1-(3-sulfamoylphenyl)pyrazol-5-olate;hydron.
Chemical Property Profile of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)
Property Insights of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)
The XLogP value of 4.97782 indicates that Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 395.0 Ų indicates high polarity, suggesting Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) has 3 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)?
The CAS number of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) is 72928-86-0.
What is the molecular formula of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)?
The molecular formula of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) is C42H45CrN12O12S2.
What is the molecular weight of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)?
The molecular weight of Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) is 1025.21 g/mol.
Where can I buy Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)?
You can request a quote for Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.