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91441-23-5

91441-23-5 structural image
Product Name: Piroxantrone
Formula: C21H25N5O4
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility H2O > 11.20 (mg/mL)
Stability/Shelf Life Bulk: Samples stored at 25 °C under both light and dark conditions at 50 °C in the dark for three months showed no significant degradation (HPLC). Solution: A solution containing 10.2 mg/mL in water showed approximately 5% degradation in 24 hours. The test sample exhibited < 10% degradation in 48 hours.

COMPUTED DESCRIPTORS

Molecular Weight 411.5 g/mol
XLogP3 -1.1
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 8
Exact Mass 411.19065430 g/mol
Monoisotopic Mass 411.19065430 g/mol
Topological Polar Surface Area 143 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 997
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

Piroxantrone is an anthrapyrazole antineoplastic antibiotic. Piroxantrone intercalates into DNA and interacts with topoisomerase II, thereby inhibiting DNA replication and repair and RNA and protein synthesis. Although less cardiotoxic than doxorubicin, this agent exhibits a narrow spectrum of antineoplastic activity. (NCI04)