RefChem:417267

(1,5-dimethyl-2-phenyl-1,5-dihydropyrazol-1-ium-3-yl)-(2-methyl-1H-indol-3-yl)diazene;methyl sulfate

Also Known As: 1,5-Dimethyl-3-((2-methyl-1H-indol-3-yl)azo)-2-phenyl-1H-pyrazolium methyl sulphate|1H-Pyrazolium, 1,5-dimethyl-3-((2-methyl-1H-indol-3-yl)azo)-2-phenyl-, methyl sulfate|1H-Pyrazolium, 1,5-dimethyl-3-[(2-methyl-1H-indol-3-yl)azo]-2-phenyl-, methyl sulfate|Pyrazolium, 2,3-dimethyl-5-((2-methylindol-3-yl)azo)-1-phenyl-, methyl sulfate|1,5-dimethyl-3-[ azo]-2-phenyl-1H-pyrazoliummethylsulphate|1,5-dimethyl-3-[(2-methyl-1H-indol-3-yl)azo]-2-phenyl-1H-pyrazolium methyl sulphate|1H-Pyrazolium, 1,5-dimethyl-3-(2-(2-methyl-1H-indol-3-yl)diazenyl)-2-phenyl-, methyl sulfate (1:1)|1H-Pyrazolium, 1,5-dimethyl-3-[(2-methyl- 1H-indol-3-yl)azo]-2-phenyl-, methyl sulfate|1,5-Dimethyl-3-[(E)-(2-methyl-1H-indol-3-yl)diazenyl]-2-phenyl-2,5-dihydro-1H-pyrazol-1-ium methyl sulfate|1,5-dimethyl-N-[(E)-(2-methylindol-3-ylidene)amino]-2-phenyl-1,5-dihydropyrazol-1-ium-3-amine,methyl sulfate|249-671-3

Molecular Formula	C21H25N5O4S
Molecular Weight	443.16272 g/mol
LogP	2.83282
Topological Polar Surface Area	123.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	3
Exact Mass	443.16272
Monoisotopic Mass	443.16272
Heavy Atoms	31
Complexity	615.0

Chemical Identifiers

CAS Number	29508-48-3
SMILES	CC1C=C(N([NH+]1C)C2=CC=CC=C2)N=NC3=C(NC4=CC=CC=C43)C.COS(=O)(=O)[O-]
InChIKey	WQWAAPRPYUZWRD-UHFFFAOYSA-N