175203-48-2
3-BENZYL-N'-HYDROXY-1-ISOPROPYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXIMIDAMIDE
Name3-BENZYL-N'-HYDROXY-1-ISOPROPYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXIMIDAMIDE
1Identification
【Name】
3-BENZYL-N'-HYDROXY-1-ISOPROPYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXIMIDAMIDE
【CAS】
【MDL】
MFCD00203980
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H18 N4 O3
【pro_molWeight】
302.332
【Inchi】
InChI=1S/C15H18N4O3/c1-10(2)18-9-12(13(16)17-22)14(20)19(15(18)21)8-11-6-4-3-5-7-11/h3-7,9-10,22H,8H2,1-2H3,(H2,16,17)
【InChIKey】
InChIKey=AJBWQWDJFIRUNT-UHFFFAOYSA-N
【SMILES】
CC(C)n1cc(c(=O)n(c1=O)Cc2ccccc2)/C(=N/O)/N
【MOL File】
3-BENZYL-N'-HYDROXY-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:7
XLogP3:-1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-BENZYL-N'-HYDROXY-1-ISOPROPYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXIMIDAMIDE.cml