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274925-86-9

274925-86-9 structural image
Product Name: 3-NITRO-5-PHENYLACETYL CATECHOL
Formula: C14H11NO5
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COMPUTED DESCRIPTORS

Molecular Weight 273.24 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 273.06372245 g/mol
Monoisotopic Mass 273.06372245 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 361
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

Nebicapone is under investigation in clinical trial NCT03097211 (Effect of BIA 6-512 at Steady-state on the Levodopa Pharmacokinetics With a Single-dose of Levodopa/Benserazide 200/50 mg or With a Single-dose of Levodopa/Benserazide 200/50 mg Plus a Single-dose of Nebicapone 150 mg).