596810-02-5
4-[[4-[3-(4-CYANOPHENOXY)PROPYL]-1-PIPERAZINYL]METHYL]-BENZONITRILE
Name4-[[4-[3-(4-CYANOPHENOXY)PROPYL]-1-PIPERAZINYL]METHYL]-BENZONITRILE
1Identification
【Name】
4-[[4-[3-(4-CYANOPHENOXY)PROPYL]-1-PIPERAZINYL]METHYL]-BENZONITRILE
【CAS】
【MDL】
MFCD22051560
【English Synonyms】
【Formula】
C22 H24 N4 O
【MolWeight】
360.459
【Inchi】
InChI=1S/C22H24N4O/c23-16-19-2-4-21(5-3-19)18-26-13-11-25(12-14-26)10-1-15-27-22-8-6-20(17-24)7-9-22/h2-9H,1,10-15,18H2
【InChIKey】
InChIKey=GMILKGVRPCOWNJ-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CN2CCN(CC2)CCCOc3ccc(cc3)C#N)C#N
【MOL File】
4-[[4-[3-(4-CYANOPHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[[4-[3-(4-CYANOPHENOXY)PROPYL]-1-PIPERAZINYL]METHYL]-BENZONITRILE.cml