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Substance Name: Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, methyl ester
RN: 78533-56-9
InChIKey: WLBGWFKXOHEAKP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N3-O2

Molecular Weight

  • 233.27
 
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Names and Synonyms

Synonyms

  • (1,4,5,6-Tetrahydro-5-phenyl-2-pyrimidinyl)carbamic acid methyl ester
  • 2-((Methoxycarbonyl)amino)-5-phenyl-1,4,5,6-tetrahydropyrimidine
  • BRN 5752678

Systematic Name

  • Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 78533-56-9

System Generated Number

  • 0078533569

Structure Descriptors

InChI

1S/C12H15N3O2/c1-17-12(16)15-11-13-7-10(8-14-11)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H2,13,14,15,16)

InChIKey

WLBGWFKXOHEAKP-UHFFFAOYSA-N

Smiles

c1([C@@H]2CNC(NC(OC)=O)=NC2)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 27mg/kg (27mg/kg)   Journal of Medicinal Chemistry. Vol. 28, Pg. 694, 1985.
mouse LD50 oral 142mg/kg (142mg/kg)   Journal of Medicinal Chemistry. Vol. 28, Pg. 694, 1985.