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Substance Name: Pyrazolo(1,5-a)pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(2-(trifluoromethyl)phenyl)-, 1-methylethyl ester
RN: 106613-68-7
InChIKey: LECLBIWUKZTKQA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H18-F3-N3-O2

Molecular Weight

  • 365.3532
 
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Names and Synonyms

Synonym

  • 6-Isopropoxycarbonyl-5-methyl-7-(2-trifluoromethylphenyl)-4,7-dihydropyrazolo(1,5-a)pyrimidine

Systematic Name

  • Pyrazolo(1,5-a)pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(2-(trifluoromethyl)phenyl)-, 1-methylethyl ester

Registry Numbers

CAS Registry Number

  • 106613-68-7

System Generated Number

  • 0106613687

Structure Descriptors

InChI

1S/C18H18F3N3O2/c1-10(2)26-17(25)15-11(3)23-14-8-9-22-24(14)16(15)12-6-4-5-7-13(12)18(19,20)21/h4-10,16,23H,1-3H3

InChIKey

LECLBIWUKZTKQA-UHFFFAOYSA-N

Smiles

CC1=C(C(n2c(ccn2)N1)c3ccccc3C(F)(F)F)C(=O)OC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 250mg/kg (250mg/kg)   United States Patent Document. Vol. #4918074,
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4918074,