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Substance Name: 1H-Pyrazole, 4,5-dihydro-1-acetyl-3-(4-oxo-2-phenyl-4H-1-benzopyran-6-yl)-5-phenyl-
RN: 154185-84-9
InChIKey: AZVDWIIWTGDKNJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H20-N2-O3

Molecular Weight

  • 408.455
 
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Names and Synonyms

Synonym

  • 1-Acetyl-3-(4-oxo-2-phenyl-4H-1-benzopyran-6-yl)-5-phenyl-4,5-dihydro-1H-pyrazole

Systematic Name

  • 1H-Pyrazole, 4,5-dihydro-1-acetyl-3-(4-oxo-2-phenyl-4H-1-benzopyran-6-yl)-5-phenyl-

Registry Numbers

CAS Registry Number

  • 154185-84-9

System Generated Number

  • 0154185849

Structure Descriptors

InChI

1S/C26H20N2O3/c1-17(29)28-23(18-8-4-2-5-9-18)15-22(27-28)20-12-13-25-21(14-20)24(30)16-26(31-25)19-10-6-3-7-11-19/h2-14,16,23H,15H2,1H3

InChIKey

AZVDWIIWTGDKNJ-UHFFFAOYSA-N

Smiles

CC(=O)N1C(CC(=N1)c2ccc3c(c2)c(=O)cc(o3)c4ccccc4)c5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 681mg/kg (681mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 32, Pg. 1241, 1993.