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Substance Name: 1-Piperazineethanol, 4-(3-(2-(trifluoromethyl)phenothiazin-10-yl)propyl)-, acetate
RN: 2021-89-8
InChIKey: VZXRBTTXAUZWBO-UHFFFAOYSA-N

Molecular Formula

  • C24-H28-F3-N3-O2-S

Molecular Weight

  • 479.564
 
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Names and Synonyms

Synonyms

  • 4-(3-(2-(Trifluoromethyl)phenothiazin-10-yl)propyl)-1-piperazineethanol acetate
  • BRN 0731494
  • NSC 226515

Systematic Names

  • 1-Piperazineethanol, 4-(3-(2-(trifluoromethyl)-10H-phenothiazin-10-yl)propyl)-, acetate (ester) (9CI)
  • 1-Piperazineethanol, 4-(3-(2-(trifluoromethyl)phenothiazin-10-yl)propyl)-, acetate

Registry Numbers

CAS Registry Number

  • 2021-89-8

System Generated Number

  • 0002021898

Structure Descriptors

InChI

1S/C24H28F3N3O2S/c1-18(31)32-16-15-29-13-11-28(12-14-29)9-4-10-30-20-5-2-3-6-22(20)33-23-8-7-19(17-21(23)30)24(25,26)27/h2-3,5-8,17H,4,9-16H2,1H3

InChIKey

VZXRBTTXAUZWBO-UHFFFAOYSA-N

Smiles

N1(c2c(ccc(C(F)(F)F)c2)Sc2c1cccc2)CCCN1CCN(CCOC(=O)C)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 71mg/kg (71mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00140,