866604-82-2
4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-N-(2-METHYLPROPYL)-4-PHENYL-5-ISOXAZOLEACETAMIDE
Name4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-N-(2-METHYLPROPYL)-4-PHENYL-5-ISOXAZOLEACETAMIDE
1Identification
【Name】
4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-N-(2-METHYLPROPYL)-4-PHENYL-5-ISOXAZOLEACETAMIDE
【CAS】
【MDL】
MFCD16878611
【English Synonyms】
【Formula】
C21 H26 N2 O3
【MolWeight】
354.447
【Inchi】
InChI=1S/C21H26N2O3/c1-14(2)13-23-21(16-8-10-17(24)11-9-16)20(15-6-4-3-5-7-15)18(26-23)12-19(22)25/h3-11,14,18,20-21,24H,12-13H2,1-2H3,(H2,22,25)
【InChIKey】
InChIKey=XBETWFFJEHRYJF-UHFFFAOYSA-N
【SMILES】
CC(C)CN1C(C(C(O1)CC(=O)N)c2ccccc2)c3ccc(cc3)O
【MOL File】
4,5-DIHYDRO-3-(4-HYD….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-N-(2-METHYLPROPYL)-4-PHENYL-5-ISOXAZOLEACETAMIDE.cml