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Substance Name: Piperazine, 1-methyl-4-((1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl)acetyl)-
RN: 87344-19-2
InChIKey: BMEDLKNPIHMCSO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N3-O2

Molecular Weight

  • 339.4365
 
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Names and Synonyms

Synonym

  • 1-Methyl-4-((1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl)acetyl)piperazine

Systematic Name

  • Piperazine, 1-methyl-4-((1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl)acetyl)-

Registry Numbers

CAS Registry Number

  • 87344-19-2

System Generated Number

  • 0087344192

Structure Descriptors

InChI

1S/C20H25N3O2/c1-15-4-6-16(7-5-15)20(25)18-9-8-17(22(18)3)14-19(24)23-12-10-21(2)11-13-23/h4-9H,10-14H2,1-3H3

InChIKey

BMEDLKNPIHMCSO-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)C(=O)c2ccc(n2C)CC(=O)N3CCN(CC3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 770mg/kg (770mg/kg)   British UK Patent Application. Vol. #2115417,
mouse LD50 oral 1200mg/kg (1200mg/kg)   British UK Patent Application. Vol. #2115417,
rat LD50 intraperitoneal 590mg/kg (590mg/kg)   British UK Patent Application. Vol. #2115417,
rat LD50 oral 1gm/kg (1000mg/kg)   British UK Patent Application. Vol. #2115417,