Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3H-Indazol-3-one, 2,3a,4,5-tetrahydro-4-(1,3-benzodioxol-5-yl)-6-(2-hydroxy-4-methoxyphenyl)-
RN: 101986-23-6
InChIKey: ALVSGDXPGRNMRR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H18-N2-O5

Molecular Weight

  • 378.3822
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2,3a,4,5-Tetrahydro-4-(1,3-benzodioxol-5-yl)-6-(2-hydroxy-4-methoxyphenyl)-3H-indazol-3-one
  • BRN 5649099

Systematic Name

  • 3H-Indazol-3-one, 2,3a,4,5-tetrahydro-4-(1,3-benzodioxol-5-yl)-6-(2-hydroxy-4-methoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 101986-23-6

System Generated Number

  • 0101986236

Structure Descriptors

InChI

1S/C21H18N2O5/c1-26-13-3-4-14(17(24)9-13)12-6-15(20-16(7-12)22-23-21(20)25)11-2-5-18-19(8-11)28-10-27-18/h2-5,7-9,15,20,24H,6,10H2,1H3,(H,23,25)

InChIKey

ALVSGDXPGRNMRR-UHFFFAOYSA-N

Smiles

COc1ccc(c(c1)O)C2=CC3=NNC(=O)C3C(C2)c4ccc5c(c4)OCO5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 24, Pg. 645, 1985.