828939-94-2
6-(4-HYDROXYPHENYL)-2-[(4-HYDROXYPHENYL)METHYL]-8-(1-METHYLETHYL)-IMIDAZO[1,2-A]PYRAZIN-3(7H)-ONE
Name6-(4-HYDROXYPHENYL)-2-[(4-HYDROXYPHENYL)METHYL]-8-(1-METHYLETHYL)-IMIDAZO[1,2-A]PYRAZIN-3(7H)-ONE
1Identification
【Name】
6-(4-HYDROXYPHENYL)-2-[(4-HYDROXYPHENYL)METHYL]-8-(1-METHYLETHYL)-IMIDAZO[1,2-A]PYRAZIN-3(7H)-ONE
【CAS】
【MDL】
MFCD16877820
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C22 H21 N3 O3
【pro_molWeight】
375.426
【Inchi】
InChI=1S/C22H21N3O3/c1-13(2)20-21-24-18(11-14-3-7-16(26)8-4-14)22(28)25(21)12-19(23-20)15-5-9-17(27)10-6-15/h3-10,12-13,23,26-27H,11H2,1-2H3
【InChIKey】
InChIKey=OTNZKJINOOEGSG-UHFFFAOYSA-N
【SMILES】
CC(C)c1c-2nc(c(=O)n2cc([nH]1)c3ccc(cc3)O)Cc4ccc(cc4)O
【MOL File】
6-(4-HYDROXYPHENYL)-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:6
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
6-(4-HYDROXYPHENYL)-2-[(4-HYDROXYPHENYL)METHYL]-8-(1-METHYLETHYL)-IMIDAZO[1,2-A]PYRAZIN-3(7H)-ONE.cml