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899541-58-3

899541-58-3 structural image
Product Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-(2-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Formula: C23H20F3N5O2S
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COMPUTED DESCRIPTORS

Molecular Weight 487.5 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 487.12898056 g/mol
Monoisotopic Mass 487.12898056 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 822
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