3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid
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![3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/474473e0bf844e029b0fe05561573b5d.png "3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid")
3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid
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CAS No:
85895-96-1
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Formula:
C24H21ClN6O6S
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Chemical Name:
3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,3-[2-[1-[4-[(4-amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxy-;Benzenesulfonic acid,3-[[1-[4-[(4-amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-5-chloro-4-hydroxy-;3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid
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CAS No:
3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid Basic Attributes
556.97814
556.98
288-772-7
Computed Properties
Molecular Weight:557.0
XLogP3:2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:556.0931813
Monoisotopic Mass:556.0931813
Topological Polar Surface Area:196
Heavy Atom Count:38
Complexity:1060
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-[2-[1-[4-[(4-Amino-3-methylbenzoyl)amino]phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-5-chloro-4-hydroxybenzenesulfonic acid
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