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110408-12-3

110408-12-3 structural image
Product Name: 1-(8-CHLORO-5-ISOQUINOLINESULFONYL)PIPERAZINE, DIHYDROCHLORIDE
Formula: C13H14ClN3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 311.79 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 311.0495256 g/mol
Monoisotopic Mass 311.0495256 g/mol
Topological Polar Surface Area 70.7 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 433
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

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