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Substance Name: 1,3-Benzodioxole, 5-(4-((2-pyrimidinyl)amino)piperidinomethyl)-
RN: 76167-77-6
InChIKey: HSPSMJLOWFXYAL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-N4-O2

Molecular Weight

  • 312.371
 
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Names and Synonyms

Synonym

  • 5-(4-((2-Pyrimidinyl)amino)piperidinomethyl)-1,3-benzodioxole

Systematic Name

  • 1,3-Benzodioxole, 5-(4-((2-pyrimidinyl)amino)piperidinomethyl)-

Registry Numbers

CAS Registry Number

  • 76167-77-6

System Generated Number

  • 0076167776

Structure Descriptors

InChI

1S/C17H20N4O2/c1-6-18-17(19-7-1)20-14-4-8-21(9-5-14)11-13-2-3-15-16(10-13)23-12-22-15/h1-3,6-7,10,14H,4-5,8-9,11-12H2,(H,18,19,20)

InChIKey

HSPSMJLOWFXYAL-UHFFFAOYSA-N

Smiles

c12c(ccc(c1)CN1CCC(Nc3ncccn3)CC1)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

VASCULAR: CONTRACTION (ISOLATED TISSUES)
Farmaco, Edizione Scientifica. Vol. 35, Pg. 951, 1980.
mouse LD50 oral > 300mg/kg (300mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

VASCULAR: CONTRACTION (ISOLATED TISSUES)
Farmaco, Edizione Scientifica. Vol. 35, Pg. 951, 1980.