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Substance Name: 2-Pyrimidinamine, 5,5'-methylenebis(N-(1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl)-N-methyl-
RN: 76167-84-5
InChIKey: BFSVNCVCIGCTDZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C37-H44-N8-O4

Molecular Weight

  • 664.8066
 
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Names and Synonyms

Synonym

  • 5,5'-Methylenebis(N-(1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl)-N-methyl-2-pyrimidinamine)

Systematic Name

  • 2-Pyrimidinamine, 5,5'-methylenebis(N-(1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl)-N-methyl-

Registry Numbers

CAS Registry Number

  • 76167-84-5

System Generated Number

  • 0076167845

Structure Descriptors

InChI

1S/C37H44N8O4/c1-42(30-7-11-44(12-8-30)22-26-3-5-32-34(16-26)48-24-46-32)36-38-18-28(19-39-36)15-29-20-40-37(41-21-29)43(2)31-9-13-45(14-10-31)23-27-4-6-33-35(17-27)49-25-47-33/h3-6,16-21,30-31H,7-15,22-25H2,1-2H3

InChIKey

BFSVNCVCIGCTDZ-UHFFFAOYSA-N

Smiles

CN(c1ncc(cn1)Cc2cnc(nc2)N(C)C3CCN(CC3)Cc4ccc5c(c4)OCO5)C6CCN(CC6)Cc7ccc8c(c7)OCO8

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 300mg/kg (300mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Farmaco, Edizione Scientifica. Vol. 35, Pg. 951, 1980.
mouse LD50 oral > 300mg/kg (300mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Farmaco, Edizione Scientifica. Vol. 35, Pg. 951, 1980.