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Substance Name: Urea, 1-(2-(bis(1-aziridinyl)phosphinyl)vinyl)-3-(p-bromophenyl)-
RN: 54948-27-5
InChIKey: KZOLMYACEQVWMI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-Br-N4-O2-P

Molecular Weight

  • 371.173
 
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Names and Synonyms

Synonyms

  • 1-(2-(Bis(1-aziridinyl)phosphinyl)vinyl)-3-(p-bromophenyl)urea
  • Phosphine oxide, bis(1-aziridinyl)((3-(p-bromophenyl)ureido)vinyl)-

Systematic Name

  • Urea, 1-(2-(bis(1-aziridinyl)phosphinyl)vinyl)-3-(p-bromophenyl)-

Registry Numbers

CAS Registry Number

  • 54948-27-5

System Generated Number

  • 0054948275

Structure Descriptors

InChI

1S/C13H16BrN4O2P/c14-11-1-3-12(4-2-11)16-13(19)15-5-10-21(20,17-6-7-17)18-8-9-18/h1-5,10H,6-9H2,(H2,15,16,19)

InChIKey

KZOLMYACEQVWMI-UHFFFAOYSA-N

Smiles

P(N1CC1)(N1CC1)(\C=C/NC(Nc1ccc(cc1)Br)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 subcutaneous 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 8, Pg. 531, 1974.