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85977-49-7

85977-49-7 structural image
Product Name: Tauromustine
Formula: C7H15ClN4O4S
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COMPUTED DESCRIPTORS

Molecular Weight 286.74 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 286.0502538 g/mol
Monoisotopic Mass 286.0502538 g/mol
Topological Polar Surface Area 108 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 353
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

PRODUCT INTRODUCTION

description

Tauromustine is a water-soluble taurine-based nitrosourea with potential antineoplastic activity. Tauromustine alkylates DNA and causes DNA cross links independent of cell cycle, thereby resulting in disruption of DNA function and induction of apoptosis.