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Substance Name: Thiopropazate [INN:BAN]
RN: 84-06-0
UNII: 0JFY081Q2X
InChIKey: AIUHRQHVWSUTGJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H28-Cl-N3-O2-S

Molecular Weight

  • 446.0122
 
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Names and Synonyms

Name of Substance

  • Thiopropazate
  • Thiopropazate [INN:BAN]

Synonyms

  • 1-(2-Acetoxyethyl)-4-(3-(2-chloro-10-phenothiazinyl)propyl)piperazine
  • 1-Piperazineethanol, 4-(3-(2-chloro-10H-phenothiazin-10-yl)propyl)-, acetate (ester)
  • 1-Piperazineethanol, 4-(3-(2-chlorophenothiazin-10-yl)propyl)-, acetate (ester)
  • 10-(3-(1-(2-Acetoxyethyl)-4-piperazinyl)propyl)-2-chlorophenothiazine
  • 2-Chloro-10-(3-(1-(2-acetoxyethyl)-4-piperazinyl)propyl)phenothiazine
  • 4-(3-(2-Chlorophenothiazin-10-yl)propyl)-1-piperazineethanol acetate
  • Dartal
  • Dartalan
  • EINECS 201-513-4
  • HSDB 3401
  • N-(beta-Acetoxyethyl)-N'-(gamma-(2'-chloro-10'-phenothiazinyl)propyl)piperazine
  • Perphenazine acetate
  • SC 7105
  • Thiopropazat
  • Thiopropazate
  • Thiopropazatum
  • Thiopropazatum [INN-Latin]
  • Tiopropazato
  • Tiopropazato [INN-Spanish]
  • UNII-0JFY081Q2X

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 84-06-0

FDA UNII

  • 0JFY081Q2X

Related Registry Number

  • 146-28-1 (di-hydrochloride)

System Generated Number

  • 0000084060

Structure Descriptors

InChI

1S/C23H28ClN3O2S/c1-18(28)29-16-15-26-13-11-25(12-14-26)9-4-10-27-20-5-2-3-6-22(20)30-23-8-7-19(24)17-21(23)27/h2-3,5-8,17H,4,9-16H2,1H3

InChIKey

AIUHRQHVWSUTGJ-UHFFFAOYSA-N

Smiles

CC(=O)OCCN1CCN(CC1)CCCN2c3ccccc3Sc4c2cc(cc4)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 1100mg/kg (1100mg/kg) BEHAVIORAL: ANTIPSYCHOTIC Archives Internationales de Pharmacodynamie et de Therapie. Vol. 149, Pg. 374, 1964.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 4.820 (none)   EST
Water Solubility 8.92 mg/L 24 EXP
Atmospheric OH Rate Constant 3.63E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.