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Substance Name: Uracil, 3-(3-bromo-4-methoxybenzyl)-5-fluoro-
RN: 102613-16-1
InChIKey: YZAUGSTYMGFVRY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H10-Br-F-N2-O3

Molecular Weight

  • 329.124
 
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Names and Synonyms

Synonym

  • 3-(3-Bromo-4-methoxybenzyl)-5-fluorouracil

Systematic Name

  • Uracil, 3-(3-bromo-4-methoxybenzyl)-5-fluoro-

Registry Numbers

CAS Registry Number

  • 102613-16-1

System Generated Number

  • 0102613161

Structure Descriptors

InChI

1S/C12H10BrFN2O3/c1-19-10-3-2-7(4-8(10)13)6-16-11(17)9(14)5-15-12(16)18/h2-5H,6H2,1H3,(H,15,18)

InChIKey

YZAUGSTYMGFVRY-UHFFFAOYSA-N

Smiles

COc1ccc(cc1Br)Cn2c(=O)c(c[nH]c2=O)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 586, 1978.