573691-04-0
2(1H)-QUINOLINETHIONE, 7-[4-[4-(2,3-DICHLOROPHENYL)-1-PIPERAZINYL]BUTOXY]-3,4-DIHYDRO-
Name2(1H)-QUINOLINETHIONE, 7-[4-[4-(2,3-DICHLOROPHENYL)-1-PIPERAZINYL]BUTOXY]-3,4-DIHYDRO-
FormulaC23 H27 Cl2 N3 O S
1Identification
【Name】
2(1H)-QUINOLINETHIONE, 7-[4-[4-(2,3-DICHLOROPHENYL)-1-PIPERAZINYL]BUTOXY]-3,4-DIHYDRO-
【CAS】
【MDL】
MFCD10565931
【English Synonyms】
【Formula】
C23 H27 Cl2 N3 O S
【MolWeight】
464.458
【Inchi】
InChI=1S/C23H27Cl2N3OS/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-29-18-8-6-17-7-9-22(30)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,30)
【InChIKey】
InChIKey=XSCIEQZAASEUST-UHFFFAOYSA-N
【SMILES】
c1cc(c(c(c1)Cl)Cl)N2CCN(CC2)CCCCOc3ccc4c(c3)NC(=S)CC4
【MOL File】
2(1H)-QUINOLINETHION….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2(1H)-QUINOLINETHIONE, 7-[4-[4-(2,3-DICHLOROPHENYL)-1-PIPERAZINYL]BUTOXY]-3,4-DIHYDRO-.cml