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Substance Name: 4(1H)-Pyrimidinone, 2-(ethyl(1-(1-((4-fluorophenyl)methyl)-1H-benzimidazol-2-yl)-4-piperidinyl)amino)-
RN: 108612-62-0
InChIKey: BSMHMUCRKHWBRS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H27-F-N6-O

Molecular Weight

  • 446.5273
 
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Names and Synonyms

  • 4(1H)-Pyrimidinone, 2-(ethyl(1-(1-((4-fluorophenyl)methyl)-1H-benzimidazol-2-yl)-4-piperidinyl)amino)-

Registry Numbers

CAS Registry Number

  • 108612-62-0

System Generated Number

  • 0108612620

Structure Descriptors

InChI

1S/C25H27FN6O/c1-2-31(24-27-14-11-23(33)29-24)20-12-15-30(16-13-20)25-28-21-5-3-4-6-22(21)32(25)17-18-7-9-19(26)10-8-18/h3-11,14,20H,2,12-13,15-17H2,1H3,(H,27,29,33)

InChIKey

BSMHMUCRKHWBRS-UHFFFAOYSA-N

Smiles

CCN(c1[nH]ccc(=O)n1)C2CCN(CC2)c3nc4ccccc4n3Cc5ccc(cc5)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,