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85622-95-3

85622-95-3 structural image
Product Name: MITOZOLOMIDE
Formula: C7H7ClN6O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility H2O 0.0 (mg/mL)

COMPUTED DESCRIPTORS

Molecular Weight 242.62 g/mol
XLogP3 -0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 242.0319012 g/mol
Monoisotopic Mass 242.0319012 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 348
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

Mitozolomide is a prodrug of imidazotetrazine alkylating agent with antineoplastic property. Mitozolomide undergoes ring opening upon the nucleophilic attack at C-4 by an activated molecule of water within the major groove of DNA. The resulting bioactive mono-alkyltriazene species are capable of alkylating nucleophilic residues in the immediate vicinity such as N-7 and/or O-6 sites of guanine, thereby causes intra- or inter-stranded DNA cross-links and trigger apoptosis.