TL;DR: RefChem:576529 (CAS 62524-44-1) is a chemical compound with molecular formula C32H20Cl3CrN8Na2O7S and molecular weight 862.94415 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;5-chloro-3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-2-oxidobenzenesulfonate;chromium(3+);4-[(3,5-dichloro-2-oxidophenyl)diazenyl]-3-methyl-1-phenylpyrazol-5-olate
Also Known As: Chromate(2-), (5-chloro-3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxybenzenesulfonato(3-))(4-((3,5-dichloro-2-hydroxyphenyl)azo)-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-))-, disodium, chromium(3+) sodium 5-chloro-3-[(z)-(3-methyl-5-oxido-1-phenyl-1h-pyrazol-4-yl)diazenyl]-2-oxidobenzenesulfonate 4-[(e)-(3,5-dichloro-2-oxidophenyl)diazenyl]-3-methyl-1-phenyl-1h-pyrazol-5-olate(1:2:1:1), 263-582-7, Chromate(2-), (5-chloro-3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-2-(hydroxy-kappaO)benzenesulfonato(3-))(4-((3,5-dichloro-2-(hydroxy-kappaO)phenyl)azo-kappaN1)-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-kappaO3)-, disodium, Chromate(2-), (5-chloro-3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxybenzenesulfonato(3-))(4-((3,5-dichloro-2-hydroxyphenyl)azo)-2,4-dihydro-5-meth yl-2-phenyl-3H-pyrazol-3-onato(2-))-, disodium
| Molecular Formula | C32H20Cl3CrN8Na2O7S |
| Molecular Weight | 862.94415 g/mol |
| XLogP | 0.36 |
| Topological Polar Surface Area (TPSA) | 243.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 862.94415 Da |
| Heavy Atoms | 54 |
| Complexity | 1080.0 |
| SMILES | CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)Cl)S(=O)(=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)Cl)Cl)[O-])[O-])C3=CC=CC=C3.[Na+].[Na+].[Cr+3] |
| InChIKey | IOWRUSATJPBFNJ-UHFFFAOYSA-I |
The XLogP value of 0.36 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:576529. The TPSA of 243.0 Ų indicates high polarity, suggesting RefChem:576529 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:576529 has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:576529 is 62524-44-1.
The molecular formula of RefChem:576529 is C32H20Cl3CrN8Na2O7S.
The molecular weight of RefChem:576529 is 862.94415 g/mol.
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