3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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![3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/89911191d4cb4fb9bbe3372e3ec0d50a.png "3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid")
3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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CAS No:
97158-36-6
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Formula:
C31H43N3O5S
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Chemical Name:
3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,3-[4,5-dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]-;3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid
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CAS No:
3-[4,5-Dihydro-5-oxo-3-[4-[(1-oxohexadecyl)amino]phenyl]-1H-pyrazol-1-yl]benzenesulfonic acid Basic Attributes
569.75500
569.76
306-367-6
DTXSID70242733
Computed Properties
Molecular Weight:569.8
XLogP3:8.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:18
Exact Mass:569.29234265
Monoisotopic Mass:569.29234265
Topological Polar Surface Area:125
Heavy Atom Count:40
Complexity:908
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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