937598-67-9
1-ETHYL-3-METHYL-6-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID
Name1-ETHYL-3-METHYL-6-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID
1Identification
【Name】
1-ETHYL-3-METHYL-6-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD08558274
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C17 H17 N3 O2
【pro_molWeight】
295.34
【Inchi】
InChI=1S/C17H17N3O2/c1-4-20-16-15(11(3)19-20)13(17(21)22)9-14(18-16)12-7-5-10(2)6-8-12/h5-9H,4H2,1-3H3,(H,21,22)
【InChIKey】
InChIKey=UBGAKLQCXDAQGK-UHFFFAOYSA-N
【SMILES】
CCn1c2c(c(n1)C)c(cc(n2)c3ccc(cc3)C)C(=O)O
【MOL File】
1-ETHYL-3-METHYL-6-(….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-ETHYL-3-METHYL-6-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID.cml