3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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![3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/582de18184bd4768b2ba2e076bef6f3e.png "3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid")
3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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CAS No:
97158-37-7
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Formula:
C33H47N3O5S
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Chemical Name:
3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,3-[4,5-dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]-;3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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CAS No:
3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxooctadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid Basic Attributes
597.80800
597.81
306-368-1
DTXSID30242734
Computed Properties
Molecular Weight:597.8
XLogP3:9.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:20
Exact Mass:597.32364278
Monoisotopic Mass:597.32364278
Topological Polar Surface Area:125
Heavy Atom Count:42
Complexity:940
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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