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Substance Name: 3H-Pyrazol-3-one, 1,2-dihydro-5-ethyl-2-(3-(4-(4-fluorophenyl)-1-piperazinyl)propyl)-1-phenyl-
RN: 104416-62-8
InChIKey: MRKKMZWXWHQYKF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H29-F-N4-O

Molecular Weight

  • 408.5181
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-5-ethyl-2-(3-(4-(4-fluorophenyl)-1-piperazinyl)propyl)-1-phenyl-3H-pyrazol-3-one
  • 5-Ethyl-1-phenyl-2-(3-(4-(4-fluorophenyl)piperazin-1-yl)propyl)pyrazolin-3-one

Systematic Name

  • 3H-Pyrazol-3-one, 1,2-dihydro-5-ethyl-2-(3-(4-(4-fluorophenyl)-1-piperazinyl)propyl)-1-phenyl-

Registry Numbers

CAS Registry Number

  • 104416-62-8

System Generated Number

  • 0104416628

Structure Descriptors

InChI

1S/C24H29FN4O/c1-2-21-19-24(30)28(29(21)23-7-4-3-5-8-23)14-6-13-26-15-17-27(18-16-26)22-11-9-20(25)10-12-22/h3-5,7-12,19H,2,6,13-18H2,1H3

InChIKey

MRKKMZWXWHQYKF-UHFFFAOYSA-N

Smiles

n1(n(c(cc1CC)=O)CCCN1CCN(CC1)c1ccc(cc1)F)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 117mg/kg (117mg/kg)   United States Patent Document. Vol. #4672063,