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1195765-45-7

1195765-45-7 structural image
Product Name: Dabrafenib
Formula: C23H20F3N5O2S2
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CHEMICAL AND PHYSICAL PROPERTIES

Boiling Point 653.7
Solubility very slightly soluble at pH 1
LogP 2.9
Dissociation Constants -1.5

COMPUTED DESCRIPTORS

Molecular Weight 519.6 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 6
Exact Mass 519.10105173 g/mol
Monoisotopic Mass 519.10105173 g/mol
Topological Polar Surface Area 148 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 817
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

Dabrafenib is an organofluorine compound and antineoplastic agent, used as its mesylate salt in treatment of metastatic melanoma. It has a role as an antineoplastic agent, a B-Raf inhibitor and an anticoronaviral agent. It is a sulfonamide, an organofluorine compound, a member of 1,3-thiazoles and an aminopyrimidine.

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