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929816-87-5

929816-87-5 structural image
Product Name: [2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazol-6-yl]-(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)methanone
Formula: C24H29N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 407.6 g/mol
XLogP3 5.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 407.20313373 g/mol
Monoisotopic Mass 407.20313373 g/mol
Topological Polar Surface Area 66.4 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 659
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes