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Substance Name: 2,4(1H,3H)-Pyrimidinedione, dihydro-6,6-dimethyl-3-(2-(4-phenyl-1-piperazinyl)ethyl)-, monohydrochloride
RN: 69950-28-3
InChIKey: FXSCNNIGFLNDPS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H26-N4-O-S.Cl-H

Molecular Weight

  • 366.8903
 
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Names and Synonyms

Synonym

  • 3-(2-(4-Phenyl-1-piperazinyl)ethyl)-6,6-dimethyl-2-thio-5,6-dihydrouracil hydrochloride

Systematic Name

  • 2,4(1H,3H)-Pyrimidinedione, dihydro-6,6-dimethyl-3-(2-(4-phenyl-1-piperazinyl)ethyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 69950-28-3

System Generated Number

  • 0069950283

Molecular Formulas

Molecular Formula

  • C18-H26-N4-O-S.Cl-H

Molecular Formula Fragments

  • C18-H26-N4-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H26N4O2.ClH/c1-18(2)14-16(23)22(17(24)19-18)13-10-20-8-11-21(12-9-20)15-6-4-3-5-7-15;/h3-7H,8-14H2,1-2H3,(H,19,24);1H

InChIKey

FXSCNNIGFLNDPS-UHFFFAOYSA-N

Smiles

CC1(CC(=O)N(C(=O)N1)CCN2CCN(CC2)c3ccccc3)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4216216,
rat LD50 intravenous 66mg/kg (66mg/kg)   United States Patent Document. Vol. #4216216,