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Substance Name: 4,6(1H,5H)-Pyrimidinedione, 1-((2,4-dichlorophenyl)methyl)-5-((hexahydro-1H-azepin-1-yl)methyl)dihydro-3-phenyl-2-thioxo-
RN: 89516-64-3
InChIKey: POSNZXAZZTYEBD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H25-Cl2-N3-O2-S

Molecular Weight

  • 490.4525
 
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Names and Synonyms

Synonym

  • BRN 4610959

Systematic Name

  • 4,6(1H,5H)-Pyrimidinedione, 1-((2,4-dichlorophenyl)methyl)-5-((hexahydro-1H-azepin-1-yl)methyl)dihydro-3-phenyl-2-thioxo-

Registry Numbers

CAS Registry Number

  • 89516-64-3

System Generated Number

  • 0089516643

Structure Descriptors

InChI

1S/C24H25Cl2N3O2S/c25-18-11-10-17(21(26)14-18)15-28-22(30)20(16-27-12-6-1-2-7-13-27)23(31)29(24(28)32)19-8-4-3-5-9-19/h3-5,8-11,14,20H,1-2,6-7,12-13,15-16H2

InChIKey

POSNZXAZZTYEBD-UHFFFAOYSA-N

Smiles

Clc1ccc(CN2C(=O)C(CN3CCCCCC3)C(=O)N(C2=S)c4ccccc4)c(Cl)c1

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. 22, Pg. 955, 1983.