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861207-39-8

861207-39-8 structural image
Product Name: 4-(2-HYDROXYETHYL)-5-METHYL-1-[(2,3,4,5,6-PENTAMETHYLPHENYL)SULFONYL]-1,2-DIHYDRO-3H-PYRAZOL-3-ONE
Formula: C17H24N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 352.5 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 352.14567842 g/mol
Monoisotopic Mass 352.14567842 g/mol
Topological Polar Surface Area 95.1 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 622
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes