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4498-32-2

4498-32-2 structural image
Product Name: Dibenzepin
Formula: C18H21N3O
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CHEMICAL AND PHYSICAL PROPERTIES

Dissociation Constants 8.275
Kovats Retention Index 2436 2476 2420 2465 2435 2443 2465.1 2449.5

COMPUTED DESCRIPTORS

Molecular Weight 295.4 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 295.168462302 g/mol
Monoisotopic Mass 295.168462302 g/mol
Topological Polar Surface Area 26.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 398
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

5-[2-(dimethylamino)ethyl]-11-methyl-6-benzo[b][1,4]benzodiazepinone is a dibenzodiazepine.