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Substance Name: Pyrimido(5,4-d)pyrimidin-4-amine, N-(phenylmethyl)-6-(1-piperazinyl)-8-(4-thiomorpholinyl)-
RN: 78552-52-0
InChIKey: LISQGJSNQRUWSI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N8-S

Molecular Weight

  • 422.5584
 
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Names and Synonyms

Synonyms

  • 8-Benzylamino-2-piperazino-4-thiomorpholino-pyrimido(5,4-d)pyrimidine
  • N-(Phenylmethyl)-6-(1-piperazinyl)-8-(4-thiomorpholinyl)pyrimido(5,4-d)pyrimidin-4-amine

Systematic Name

  • Pyrimido(5,4-d)pyrimidin-4-amine, N-(phenylmethyl)-6-(1-piperazinyl)-8-(4-thiomorpholinyl)-

Registry Numbers

CAS Registry Number

  • 78552-52-0

System Generated Number

  • 0078552520

Structure Descriptors

InChI

1S/C21H26N8S/c1-2-4-16(5-3-1)14-23-19-17-18(24-15-25-19)20(28-10-12-30-13-11-28)27-21(26-17)29-8-6-22-7-9-29/h1-5,15,22H,6-14H2,(H,23,24,25)

InChIKey

LISQGJSNQRUWSI-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CNc2c3c(c(nc(n3)N4CCNCC4)N5CCSCC5)ncn2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 250mg/kg (250mg/kg)   United States Patent Document. Vol. #4690923,