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Substance Name: Benzoic acid, 4,4'-((5,5-diethyldihydro-2,4,6-trioxo-1,3(2H,4H)-pyrimidinediyl)bis(1-oxo-2,1-ethanediyl)imino))bis-
RN: 70959-45-4
InChIKey: NPVCZWOBHSOSQK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H26-N4-O9

Molecular Weight

  • 538.5104
 
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Names and Synonyms

Synonym

  • 1,3(2H,4H)-Pyrimidine-2,4,6-trione, 5,5-diethyldihydro-1,3-bis(carboxyphenylcarbamoylmethyl)-

Systematic Name

  • Benzoic acid, 4,4'-((5,5-diethyldihydro-2,4,6-trioxo-1,3(2H,4H)-pyrimidinediyl)bis(1-oxo-2,1-ethanediyl)imino))bis-

Registry Numbers

CAS Registry Number

  • 70959-45-4

System Generated Number

  • 0070959454

Structure Descriptors

InChI

1S/C26H26N4O9/c1-3-26(4-2)23(37)29(13-19(31)27-17-9-5-15(6-10-17)21(33)34)25(39)30(24(26)38)14-20(32)28-18-11-7-16(8-12-18)22(35)36/h5-12H,3-4,13-14H2,1-2H3,(H,27,31)(H,28,32)(H,33,34)(H,35,36)

InChIKey

NPVCZWOBHSOSQK-UHFFFAOYSA-N

Smiles

CCC1(C(=O)N(C(=O)N(C1=O)CC(=O)Nc2ccc(cc2)C(=O)O)CC(=O)Nc3ccc(cc3)C(=O)O)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 30, Pg. 685, 1978.