606977-99-5
2-(BIPHENYL-4-YL)-N-[2-[3,4-BIS(BENZYLOXY)PHENYL]ETHYL]ACETAMIDE
Name2-(BIPHENYL-4-YL)-N-[2-[3,4-BIS(BENZYLOXY)PHENYL]ETHYL]ACETAMIDE
1Identification
【Name】
2-(BIPHENYL-4-YL)-N-[2-[3,4-BIS(BENZYLOXY)PHENYL]ETHYL]ACETAMIDE
【CAS】
【MDL】
MFCD12913579
【English Synonyms】
【Formula】
C36 H33 N O3
【MolWeight】
527.661
【Inchi】
InChI=1S/C36H33NO3/c38-36(25-28-16-19-33(20-17-28)32-14-8-3-9-15-32)37-23-22-29-18-21-34(39-26-30-10-4-1-5-11-30)35(24-29)40-27-31-12-6-2-7-13-31/h1-21,24H,22-23,25-27H2,(H,37,38)
【InChIKey】
InChIKey=DIIGFWSQQZIDJV-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)COc2ccc(cc2OCc3ccccc3)CCNC(=O)Cc4ccc(cc4)c5ccccc5
【MOL File】
2-(BIPHENYL-4-YL)-N-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:8.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(BIPHENYL-4-YL)-N-[2-[3,4-BIS(BENZYLOXY)PHENYL]ETHYL]ACETAMIDE.cml