About 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate)
3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate) (PubChem CID 158388180) has the molecular formula C211H220F32N57O29-3
and a molecular weight of 4626.39 g/mol. Its IUPAC name is 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate).
Frequently Asked Questions
What is the IUPAC name of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate)?
The IUPAC name of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate) (CID 158388180) is 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate).
What is the SMILES notation for 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate)?
The canonical SMILES for 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate) is C.C.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cc[nH+]c(N5CCC(C)CC5)c4)n3)n2)cc1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(N2CCC(C)CC2)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCC(C#N)CC2)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCC(C)(C)CC2)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCC(O)CC2)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCCC2)c1.Cc1nc(-c2nc(-c3ccc(OC(C)F)cc3)no2)nn1Cc1cc[nH+]c(N2CC[NH+](C)CC2)c1.Cc1nc(-c2nc(-c3ccccc3)no2)nn1Cc1cc[nH+]c(N2CCC(C)CC2)c1.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.
What is the InChIKey of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate)?
The InChIKey is KRGGTGLUVJWLNA-UHFFFAOYSA-K. The full InChI is InChI=1S/C26H29F2N7O2.C26H28F2N6O2.C25H24F2N8O2.C24H25F2N7O3.C24H27FN8O2.C24H27N7O.C23H23F2N7O2.C23H25N7O.7C2HF3O2.2CH4/c1-17-30-23(24-31-22(33-37-24)19-5-7-20(8-6-19)36-26(4,27)28)32-35(17)16-18-9-12-29-21(15-18)34-13-10-25(2,3)11-14-34;1-17-11-13-33(14-12-17)21-6-4-5-19(15-21)16-34-18(2)29-24(31-34)25-30-23(32-36-25)20-7-9-22(10-8-20)35-26(3,27)28;1-16-30-23(24-31-22(33-37-24)19-3-5-20(6-4-19)36-25(2,26)27)32-35(16)15-18-7-10-29-21(13-18)34-11-8-17(14-28)9-12-34;1-15-28-22(23-29-21(31-36-23)17-3-5-19(6-4-17)35-24(2,25)26)30-33(15)14-16-7-10-27-20(13-16)32-11-8-18(34)9-12-32;1-16(25)34-20-6-4-19(5-7-20)22-28-24(35-30-22)23-27-17(2)33(29-23)15-18-8-9-26-21(14-18)32-12-10-31(3)11-13-32;1-16-4-6-20(7-5-16)22-27-24(32-29-22)23-26-18(3)31(28-23)15-19-8-11-25-21(14-19)30-12-9-17(2)10-13-30;1-15-27-21(29-32(15)14-16-9-10-26-19(13-16)31-11-3-4-12-31)22-28-20(30-34-22)17-5-7-18(8-6-17)33-23(2,24)25;1-16-9-12-29(13-10-16)20-14-18(8-11-24-20)15-30-17(2)25-22(27-30)23-26-21(28-31-23)19-6-4-3-5-7-19;7*3-2(4,5)1(6)7;;/h5-9,12,15H,10-11,13-14,16H2,1-4H3;4-10,15,17H,11-14,16H2,1-3H3;3-7,10,13,17H,8-9,11-12,15H2,1-2H3;3-7,10,13,18,34H,8-9,11-12,14H2,1-2H3;4-9,14,16H,10-13,15H2,1-3H3;4-8,11,14,17H,9-10,12-13,15H2,1-3H3;5-10,13H,3-4,11-12,14H2,1-2H3;3-8,11,14,16H,9-10,12-13,15H2,1-2H3;7*(H,6,7);2*1H4/p-3.
What are the key properties of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate)?
3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate) has a molecular weight of 4626.39 g/mol, XLogP of 28.13, 52 rotatable bonds, 2 hydrogen bond donors, and 82 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidine-4-carbonitrile;1-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperidin-4-ol;3-[4-(1-fluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;methane;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;5-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)pyridin-1-ium-4-yl]methyl]-1,2,4-triazol-3-yl]-3-phenyl-1,2,4-oxadiazole;heptakis(2,2,2-trifluoroacetate) is sourced from PubChem (CID 158388180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).