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714938-54-2

714938-54-2 structural image
Product Name: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
Formula: C22H31N5O2S
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COMPUTED DESCRIPTORS

Molecular Weight 429.6 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 429.21984642 g/mol
Monoisotopic Mass 429.21984642 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 582
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