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Substance Name: Piperazine, 1-(bis(4-fluorophenyl)methyl)-4-(3-(2-((2-methoxyphenoxy)methyl)-3-thiazolidinyl)-1,3-dioxopropyl)-
RN: 161364-79-0
InChIKey: DWNIUJLSEZPCRP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H33-F2-N3-O4-S

Molecular Weight

  • 581.6807
 
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Names and Synonyms

  • Piperazine, 1-(bis(4-fluorophenyl)methyl)-4-(3-(2-((2-methoxyphenoxy)methyl)-3-thiazolidinyl)-1,3-dioxopropyl)-

Registry Numbers

CAS Registry Number

  • 161364-79-0

System Generated Number

  • 0161364790

Structure Descriptors

InChI

1S/C31H33F2N3O4S/c1-39-26-4-2-3-5-27(26)40-21-30-36(18-19-41-30)29(38)20-28(37)34-14-16-35(17-15-34)31(22-6-10-24(32)11-7-22)23-8-12-25(33)13-9-23/h2-13,30-31H,14-21H2,1H3

InChIKey

DWNIUJLSEZPCRP-UHFFFAOYSA-N

Smiles

COc1ccccc1OCC2N(CCS2)C(=O)CC(=O)N3CCN(CC3)C(c4ccc(cc4)F)c5ccc(cc5)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 38, Pg. 508, 1995.