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Substance Name: Urea, N-(2-(bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl)-N-hydroxy-N'-(3-(trifluoromethyl)phenyl)-, P-oxide
RN: 97139-38-3
InChIKey: NPYKRGVGRYRMHG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-F3-Cl2-N5-O6-P

Molecular Weight

  • 479.221
 
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Names and Synonyms

  • Urea, N-(2-(bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl)-N-hydroxy-N'-(3-(trifluoromethyl)phenyl)-, P-oxide

Registry Numbers

CAS Registry Number

  • 97139-38-3

System Generated Number

  • 0097139383

Structure Descriptors

InChI

1S/C15H20Cl2F3N4O4P/c16-5-7-23(8-6-17)29(27)22-13(4-9-28-29)24(26)14(25)21-12-3-1-2-11(10-12)15(18,19)20/h1-3,10,13,26H,4-9H2,(H,21,25)(H,22,27)

InChIKey

NPYKRGVGRYRMHG-UHFFFAOYSA-N

Smiles

ON(C1CCOP(=O)(N1)N(CCCl)CCCl)C(=O)Nc2cccc(c2)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4618692,