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871110-28-0

871110-28-0 structural image
Product Name: 1,5-DIPHENYL-4-ETHYL-3-METHYLTHIO-1H-PYRAZOLE
Formula: C18H18N2S
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COMPUTED DESCRIPTORS

Molecular Weight 294.4 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 294.11906976 g/mol
Monoisotopic Mass 294.11906976 g/mol
Topological Polar Surface Area 43.1 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 310
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