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36735-22-5

36735-22-5 structural image
Product Name: QUAZEPAM
Formula: C17H11ClF4N2S
Synonyms: 7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-1-(2,2,2-trifluoroethyl)- 2H-1,4-benzodiazepine-2-thione
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 137.5-139 °C
Solubility 2.31e-03 g/L
LogP 4.03
Collision Cross Section 174.9 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Kovats Retention Index 2485

COMPUTED DESCRIPTORS

Molecular Weight 386.8 g/mol
XLogP3 4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 386.0267599 g/mol
Monoisotopic Mass 386.0267599 g/mol
Topological Polar Surface Area 47.7 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 539
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

Quazepam is a benzodiazepine.