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Substance Name: 2,4-Diamino-5-adamantyl-6-methyl-pyrimidine ethanesulfonate
RN: 35507-78-9
InChIKey: SSCSUZHOFNPPSA-UHFFFAOYSA-N

Note

  • Lipid-soluble antifolate.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-N4.C2-H6-O3-S

Molecular Weight

  • 368.499
 
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Names and Synonyms

Name of Substance

  • 2,4-Diamino-5-adamantyl-6-methyl-pyrimidine ethanesulfonate

Synonyms

  • 5-(1-Adamantyl)-2,4-diamino-6-methylpyrimidine ethylsulfonate
  • DAMP-ES

Systematic Name

  • Pyrimidine, 5-(1-adamantyl)-2,4-diamino-6-methyl-, ethylsulfonate

Registry Numbers

CAS Registry Number

  • 35507-78-9

System Generated Number

  • 0035507789

Molecular Formulas

Molecular Formula

  • C15-H22-N4.C2-H6-O3-S

Molecular Formula Fragments

  • C15-H22-N4
  • C2-H6-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C15H22N4.C2H6O3S/c1-8-12(13(16)19-14(17)18-8)15-5-9-2-10(6-15)4-11(3-9)7-15;1-2-6(3,4)5/h9-11H,2-7H2,1H3,(H4,16,17,18,19);2H2,1H3,(H,3,4,5)

InChIKey

SSCSUZHOFNPPSA-UHFFFAOYSA-N

Smiles

C1C2CC3CC1CC(C3)(c1c(N)nc(N)nc1C)C2.S(CC)(O)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 40mg/kg (40mg/kg) LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA

BEHAVIORAL: EXCITEMENT

BLOOD: OTHER CHANGES
Journal of the National Cancer Institute. Vol. 60, Pg. 1029, 1978.
rat LD50 intraperitoneal 23mg/kg (23mg/kg) LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA

BEHAVIORAL: EXCITEMENT

BLOOD: OTHER CHANGES
Journal of the National Cancer Institute. Vol. 60, Pg. 1029, 1978.