933011-11-1
(E)-3-METHYL-4-(2-(2-PHENOXYPHENYL)HYDRAZONO)-1-PHENYL-1H-PYRAZOL-5(4H)-ONE
Name(E)-3-METHYL-4-(2-(2-PHENOXYPHENYL)HYDRAZONO)-1-PHENYL-1H-PYRAZOL-5(4H)-ONE
1Identification
【Name】
(E)-3-METHYL-4-(2-(2-PHENOXYPHENYL)HYDRAZONO)-1-PHENYL-1H-PYRAZOL-5(4H)-ONE
【CAS】
【MDL】
MFCD09910484
【English Synonyms】
【Formula】
C22 H18 N4 O2
【MolWeight】
370.41
【Inchi】
InChI=1S/C22H18N4O2/c1-16-21(22(27)26(25-16)17-10-4-2-5-11-17)24-23-19-14-8-9-15-20(19)28-18-12-6-3-7-13-18/h2-15,23H,1H3/b24-21+
【InChIKey】
InChIKey=QIYMCEJGZBQLKI-DARPEHSRSA-N
【SMILES】
CC\1=NN(C(=O)/C1=N/Nc2ccccc2Oc3ccccc3)c4ccccc4
【MOL File】
(E)-3-METHYL-4-(2-(2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(E)-3-METHYL-4-(2-(2-PHENOXYPHENYL)HYDRAZONO)-1-PHENYL-1H-PYRAZOL-5(4H)-ONE.cml