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Substance Name: 1,3-Indandione, 2-(4-(4-(p-methoxyphenyl)-1-piperazinyl)-2-butyn-1-yl)-2-phenyl-
RN: 37742-01-1
InChIKey: RHPSBQSURGJVIY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H28-N2-O3

Molecular Weight

  • 464.5622
 
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Names and Synonyms

Synonyms

  • 2-(4-(4-(p-Methoxyphenyl)-1-piperazinyl)-2-butyn-1-yl)-2-phenyl-1,3-indandione
  • 5-23-02-00239 (Beilstein Handbook Reference)
  • BRN 0864938

Systematic Name

  • 1,3-Indandione, 2-(4-(4-(p-methoxyphenyl)-1-piperazinyl)-2-butyn-1-yl)-2-phenyl-

Registry Numbers

CAS Registry Number

  • 37742-01-1

System Generated Number

  • 0037742011

Structure Descriptors

InChI

1S/C30H28N2O3/c1-35-25-15-13-24(14-16-25)32-21-19-31(20-22-32)18-8-7-17-30(23-9-3-2-4-10-23)28(33)26-11-5-6-12-27(26)29(30)34/h2-6,9-16H,17-22H2,1H3

InChIKey

RHPSBQSURGJVIY-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)N2CCN(CC2)CC#CCC3(C(=O)c4ccccc4C3=O)c5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3650mg/kg (3650mg/kg) BEHAVIORAL: ANTIPSYCHOTIC

BEHAVIORAL: ANALGESIA
Pharmaceutical Chemistry Journal Vol. 7, Pg. 691, 1973.