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83391-21-3

83391-21-3 structural image
Product Name: 1-(7-BENZYLIDENE-3-PHENYL-3,3A,4,5,6,7-HEXAHYDRO-INDAZOL-2-YL)-2-CHLORO-ETHANONE
Formula: C22H21ClN2O
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COMPUTED DESCRIPTORS

Molecular Weight 364.9 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 364.1342410 g/mol
Monoisotopic Mass 364.1342410 g/mol
Topological Polar Surface Area 32.7 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 573
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes