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13993-65-2

13993-65-2 structural image
Product Name: metiazinic acid
Formula: C15H13NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 271.3 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 271.06669983 g/mol
Monoisotopic Mass 271.06669983 g/mol
Topological Polar Surface Area 65.8 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 349
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

Metiazinic acid is phenothiazine substituted at nitrogen by a methyl group and at C-2 by a carboxymethyl group. It has a role as a non-steroidal anti-inflammatory drug and a drug allergen. It is functionally related to a 10H-phenothiazine.