140423-96-7
5-(4-METHYLPHENYL)-3-(3,4,5-TRIMETHOXYPHENYL)THIAZOLO(2,3-C)-1,2,4-TRIAZOLE
Name5-(4-METHYLPHENYL)-3-(3,4,5-TRIMETHOXYPHENYL)THIAZOLO(2,3-C)-1,2,4-TRIAZOLE
pro_formulaC20 H19 N3 O3 S
1Identification
【Name】
5-(4-METHYLPHENYL)-3-(3,4,5-TRIMETHOXYPHENYL)THIAZOLO(2,3-C)-1,2,4-TRIAZOLE
【CAS】
【MDL】
MFCD01680675
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C20 H19 N3 O3 S
【pro_molWeight】
381.454
【Inchi】
InChI=1S/C20H19N3O3S/c1-12-5-7-13(8-6-12)15-11-27-20-22-21-19(23(15)20)14-9-16(24-2)18(26-4)17(10-14)25-3/h5-11H,1-4H3
【InChIKey】
InChIKey=DBXXBLCDKBQCCO-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)c2csc3n2c(nn3)c4cc(c(c(c4)OC)OC)OC
【MOL File】
5-(4-METHYLPHENYL)-3….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:6
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-(4-METHYLPHENYL)-3-(3,4,5-TRIMETHOXYPHENYL)THIAZOLO(2,3-C)-1,2,4-TRIAZOLE.cml