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Substance Name: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-1-(3-(diethylamino)propyl)-5-(o-fluorophenyl)-, dihydrochloride
RN: 4130-75-0
InChIKey: QUYLCUGBYNYTMQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-Cl-F-N3-O.2Cl-H

Molecular Weight

  • 474.8323
 
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Names and Synonyms

  • 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-1-(3-(diethylamino)propyl)-5-(o-fluorophenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 4130-75-0

System Generated Number

  • 0004130750

Molecular Formulas

Molecular Formula

  • C22-H25-Cl-F-N3-O.2Cl-H

Molecular Formula Fragments

  • C22-H25-Cl-F-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25ClFN3O.2ClH/c1-3-26(4-2)12-7-13-27-20-11-10-16(23)14-18(20)22(25-15-21(27)28)17-8-5-6-9-19(17)24;;/h5-6,8-11,14H,3-4,7,12-13,15H2,1-2H3;2*1H

InChIKey

QUYLCUGBYNYTMQ-UHFFFAOYSA-N

Smiles

CCN(CC)CCCN1c2ccc(cc2C(=NCC1=O)c3ccccc3F)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 179mg/kg (179mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)"

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ANTICONVULSANT
Journal of Medicinal Chemistry. Vol. 8, Pg. 815, 1965.