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Substance Name: 1-Piperazineethanol, 1-(4-(2-hydroxy-5-methoxyphenyl)-1-oxo-4-phenylbutyl)-
RN: 104688-47-3
InChIKey: UYQCDULDLMDPFU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-N2-O4

Molecular Weight

  • 398.5
 
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Names and Synonyms

Synonyms

  • 1-(4-(2-Hydroxy-5-methoxyphenyl)-1-oxo-4-phenylbutyl)-1-piperazineethanol
  • BRN 4211482

Systematic Name

  • 1-Piperazineethanol, 1-(4-(2-hydroxy-5-methoxyphenyl)-1-oxo-4-phenylbutyl)-

Registry Numbers

CAS Registry Number

  • 104688-47-3

System Generated Number

  • 0104688473

Structure Descriptors

InChI

1S/C23H30N2O4/c1-29-19-7-9-22(27)21(17-19)20(18-5-3-2-4-6-18)8-10-23(28)25-13-11-24(12-14-25)15-16-26/h2-7,9,17,20,26-27H,8,10-16H2,1H3

InChIKey

UYQCDULDLMDPFU-UHFFFAOYSA-N

Smiles

N1(CCO)CCN(CC1)C(CC[C@@H](c1ccccc1)c1c(ccc(c1)OC)O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 38, Pg. 1570, 1990.