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77086-21-6

77086-21-6 structural image
Product Name: Dizocilpine
Formula: C16H15N
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form White solid from cyclohexane
Melting Point 68.5-69 °C
Optical Rotation Specific optical rotation: +161.4 deg at 20 °C/589 ( c = 0.038 g/2 ml ethanol)
Other Experimental Properties MW: 337.37. Crystalline solid; MP: 208.5-210 °C; Specific optical rotation: +114 deg at 20 °C/D ( c = 0.0128 g/2 ml ethanol) /Maleate/

COMPUTED DESCRIPTORS

Molecular Weight 221.30 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 221.120449483 g/mol
Monoisotopic Mass 221.120449483 g/mol
Topological Polar Surface Area 12 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 313
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

Dizocilpine is an organic heterotetracyclic compound that is 1-methyl-8-azabicyclo[3.2.1]octane ortho-fused to two benzene rings at positions 2-3 and 6-7 (the 5S,10R-stereoisomer). It is a non-competitive antagonist of the N-methyl-D-aspartate (NMDA) receptor and affects cognitive function, learning, and memory. It has a role as a NMDA receptor antagonist, an anaesthetic, an anticonvulsant, a nicotinic antagonist and a neuroprotective agent. It is a secondary amino compound and a tetracyclic antidepressant. It is a conjugate base of a dizocilpine(1+).