RefChem:576387
TL;DR: RefChem:576387 (CAS 68966-92-7) is a chemical compound with molecular formula C34H30CrN10NaO8S2 and molecular weight 845.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;chromium(3+);bis(3-methyl-4-[[5-(methylsulfamoyl)-2-oxidophenyl]diazenyl]-1-phenylpyrazol-5-olate)
Also Known As: Chromate(1-), bis(3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-4-(hydroxy-kappaO)-N-methylbenzenesulfonamidato(2-))-, sodium, Chromate(1-), bis(3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-N-methylbenzenesulfonamidato(2-))-, sodium (1:1), Chromate(1-), bis[3-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-4-(hydroxy-.kappa.O)-N-methylbenzenesulfonamidato(2-)]-, sodium, Chromate(1-), bis[3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-N-methylbenzenesulfonamidato(2-)]-, sodium, Chromate(1-), bis[3-[2-[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]diazenyl-.kappa.N1]-4-(hydroxy-.kappa.O)-N-methylbenzenesulfonamidato(2-)]-, sodium (1:1)
| Molecular Formula | C34H30CrN10NaO8S2 |
|---|---|
| Molecular Weight | 845.10 g/mol |
| LogP | 0.30434 |
| Topological Polar Surface Area | 286.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 845.09924 |
| Heavy Atoms | 56 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 68966-92-7 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC=C3.[Na+].[Cr+3] |
| InChIKey | QDOFQQFFQGQEPW-UHFFFAOYSA-J |
Product Overview
RefChem:576387 (CAS 68966-92-7), with molecular formula C34H30CrN10NaO8S2 and molecular weight 845.10 g/mol. IUPAC: sodium;chromium(3+);bis(3-methyl-4-[[5-(methylsulfamoyl)-2-oxidophenyl]diazenyl]-1-phenylpyrazol-5-olate).
Chemical Property Profile of RefChem:576387
Property Insights of RefChem:576387
The XLogP value of 0.30434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:576387. The TPSA of 286.0 Ų indicates high polarity, suggesting RefChem:576387 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:576387 has 2 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:576387?
The CAS number of RefChem:576387 is 68966-92-7.
What is the molecular formula of RefChem:576387?
The molecular formula of RefChem:576387 is C34H30CrN10NaO8S2.
What is the molecular weight of RefChem:576387?
The molecular weight of RefChem:576387 is 845.10 g/mol.
Where can I buy RefChem:576387?
You can request a quote for RefChem:576387 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:576387?
Yes, KEHONG BIO provides custom synthesis services for RefChem:576387 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.