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Substance Name: 4(1H)-Pyrimidinone, 2-((1-(1-((4-fluoro-3-(trifluoromethyl)phenyl)methyl)-1H-benzimidazol-2-yl)-piperidinyl)methylamino)-
RN: 108612-70-0
InChIKey: GUNWKNOCPVTUHD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H24-F4-N6-O

Molecular Weight

  • 500.4976
 
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Names and Synonyms

  • 4(1H)-Pyrimidinone, 2-((1-(1-((4-fluoro-3-(trifluoromethyl)phenyl)methyl)-1H-benzimidazol-2-yl)-piperidinyl)methylamino)-

Registry Numbers

CAS Registry Number

  • 108612-70-0

System Generated Number

  • 0108612700

Structure Descriptors

InChI

1S/C25H24F4N6O/c1-33(23-30-11-8-22(36)32-23)17-9-12-34(13-10-17)24-31-20-4-2-3-5-21(20)35(24)15-16-6-7-19(26)18(14-16)25(27,28)29/h2-8,11,14,17H,9-10,12-13,15H2,1H3,(H,30,32,36)

InChIKey

GUNWKNOCPVTUHD-UHFFFAOYSA-N

Smiles

CN(c1[nH]ccc(=O)n1)C2CCN(CC2)c3nc4ccccc4n3Cc5ccc(c(c5)C(F)(F)F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4820710,