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1088-11-5

1088-11-5 structural image
Product Name: Nordazepam
Formula: C15H11ClN2O
Synonyms: 7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one;Desmethyldiazepam;Nordiazepam
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >40.6 [ug/mL] (The mean of the results at pH 7.4)
Collision Cross Section 160.1 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Kovats Retention Index 2490 2494 2510 2507 2504 2462 2500 2493 2493 2493 2522 2521 2489 2480 2517 2554 2510 2555 2496 2522 2520 2500.8 2483.7 2523 2552 2502 2462 2529 2514.4 2480 2480

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 270.71 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 270.0559907 g/mol
Monoisotopic Mass 270.0559907 g/mol
Topological Polar Surface Area 41.5 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 376
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

Nordazepam is a 1,4-benzodiazepinone having phenyl and chloro substituents at positions 5 and 7 respectively; it has anticonvulsant, anxiolytic, muscle relaxant and sedative properties but is used primarily in the treatment of anxiety. It has a role as a GABA modulator, an anxiolytic drug, an anticonvulsant, a sedative and a human metabolite. It is a 1,4-benzodiazepinone and an organochlorine compound.