135446-07-0
5H-1,2,4-TRIAZOLO(3,4-I)PURIN-5-ONE, 6,9-DIHYDRO-3,9-DIMETHYL-6-(PHENY LMETHYL)-
Name5H-1,2,4-TRIAZOLO(3,4-I)PURIN-5-ONE, 6,9-DIHYDRO-3,9-DIMETHYL-6-(PHENY LMETHYL)-
1Identification
【Name】
5H-1,2,4-TRIAZOLO(3,4-I)PURIN-5-ONE, 6,9-DIHYDRO-3,9-DIMETHYL-6-(PHENY LMETHYL)-
【CAS】
【MDL】
MFCD01761147
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H14 N6 O
【pro_molWeight】
294.317
【Inchi】
InChI=1S/C15H14N6O/c1-10-17-18-14-12-13(16-9-19(12)2)20(15(22)21(10)14)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3
【InChIKey】
InChIKey=VTLXSLBNOQBUGC-UHFFFAOYSA-N
【SMILES】
Cc1nnc2n1c(=O)n(c3c2n(cn3)C)Cc4ccccc4
【MOL File】
5H-1,2,4-TRIAZOLO(3,….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:7
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5H-1,2,4-TRIAZOLO(3,4-I)PURIN-5-ONE, 6,9-DIHYDRO-3,9-DIMETHYL-6-(PHENY LMETHYL)-.cml