3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole

C195H192F12N54O23 — CID 159767939

IUPAC3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole
SMILESCOCCCCc1cccc(Cn2nc(-c3nc(-c4ccc(OC(C)(F)F)cc4)no3)nc2C)c1.Cc1ccc(-c2nc(-c3nc(C)n(Cc4cccc(N(C)C)c4)n3)no2)cc1.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cccc(O)c4)n3)n2)cc1.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cnccn4)n3)n2)cc1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(N(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OC(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OCC(=O)N(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OCC(N)=O)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C25H27F2N5O3.C24H24F2N6O4.C23H23F2N5O3.C22H22F2N8O3.C22H20F2N6O4.C22H22F2N6O2.C21H22N6O.C19H17N5O2.C17H15N7O/c1-17-28-23(30-32(17)16-19-9-6-8-18(15-19)7-4-5-14-33-3)24-29-22(31-35-24)20-10-12-21(13-11-20)34-25(2,26)27;1-15-27-22(23-28-21(30-36-23)17-8-10-18(11-9-17)35-24(2,25)26)29-32(15)13-16-6-5-7-19(12-16)34-14-20(33)31(3)4;1-14(2)31-19-7-5-6-16(12-19)13-30-15(3)26-21(28-30)22-27-20(29-33-22)17-8-10-18(11-9-17)32-23(4,24)25;1-14-26-19(20-28-18(30-35-20)15-3-5-17(6-4-15)34-22(2,23)24)29-32(14)13-16-7-8-25-21(27-16)31-9-11-33-12-10-31;1-13-26-20(28-30(13)11-14-4-3-5-17(10-14)32-12-18(25)31)21-27-19(29-34-21)15-6-8-16(9-7-15)33-22(2,23)24;1-14-25-20(27-30(14)13-15-6-5-7-17(12-15)29(3)4)21-26-19(28-32-21)16-8-10-18(11-9-16)31-22(2,23)24;1-14-8-10-17(11-9-14)21-23-20(25-28-21)19-22-15(2)27(24-19)13-16-6-5-7-18(12-16)26(3)4;1-12-6-8-15(9-7-12)17-21-19(26-23-17)18-20-13(2)24(22-18)11-14-4-3-5-16(25)10-14;1-11-3-5-13(6-4-11)15-21-17(25-23-15)16-20-12(2)24(22-16)10-14-9-18-7-8-19-14/h6,8-13,15H,4-5,7,14,16H2,1-3H3;5-12H,13-14H2,1-4H3;5-12,14H,13H2,1-4H3;3-8H,9-13H2,1-2H3;3-10H,11-12H2,1-2H3,(H2,25,31);5-12H,13H2,1-4H3;5-12H,13H2,1-4H3;3-10,25H,11H2,1-2H3;3-9H,10H2,1-2H3
InChIKeyNFSXLDKBILAEJD-UHFFFAOYSA-N
MW3888.01 g/mol
LogP34.38
Rot. Bonds64

About 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole

3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole (PubChem CID 159767939) has the molecular formula C195H192F12N54O23 and a molecular weight of 3888.01 g/mol. Its IUPAC name is 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole
PubChem CID159767939
Molecular FormulaC195H192F12N54O23
Molecular Weight3888.01 g/mol
Exact Mass3885.53
IUPAC Name3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole
SMILESCOCCCCc1cccc(Cn2nc(-c3nc(-c4ccc(OC(C)(F)F)cc4)no3)nc2C)c1.Cc1ccc(-c2nc(-c3nc(C)n(Cc4cccc(N(C)C)c4)n3)no2)cc1.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cccc(O)c4)n3)n2)cc1.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cnccn4)n3)n2)cc1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(N(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OC(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OCC(=O)N(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OCC(N)=O)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C25H27F2N5O3.C24H24F2N6O4.C23H23F2N5O3.C22H22F2N8O3.C22H20F2N6O4.C22H22F2N6O2.C21H22N6O.C19H17N5O2.C17H15N7O/c1-17-28-23(30-32(17)16-19-9-6-8-18(15-19)7-4-5-14-33-3)24-29-22(31-35-24)20-10-12-21(13-11-20)34-25(2,26)27;1-15-27-22(23-28-21(30-36-23)17-8-10-18(11-9-17)35-24(2,25)26)29-32(15)13-16-6-5-7-19(12-16)34-14-20(33)31(3)4;1-14(2)31-19-7-5-6-16(12-19)13-30-15(3)26-21(28-30)22-27-20(29-33-22)17-8-10-18(11-9-17)32-23(4,24)25;1-14-26-19(20-28-18(30-35-20)15-3-5-17(6-4-15)34-22(2,23)24)29-32(14)13-16-7-8-25-21(27-16)31-9-11-33-12-10-31;1-13-26-20(28-30(13)11-14-4-3-5-17(10-14)32-12-18(25)31)21-27-19(29-34-21)15-6-8-16(9-7-15)33-22(2,23)24;1-14-25-20(27-30(14)13-15-6-5-7-17(12-15)29(3)4)21-26-19(28-32-21)16-8-10-18(11-9-16)31-22(2,23)24;1-14-8-10-17(11-9-14)21-23-20(25-28-21)19-22-15(2)27(24-19)13-16-6-5-7-18(12-16)26(3)4;1-12-6-8-15(9-7-12)17-21-19(26-23-17)18-20-13(2)24(22-18)11-14-4-3-5-16(25)10-14;1-11-3-5-13(6-4-11)15-21-17(25-23-15)16-20-12(2)24(22-16)10-14-9-18-7-8-19-14/h6,8-13,15H,4-5,7,14,16H2,1-3H3;5-12H,13-14H2,1-4H3;5-12,14H,13H2,1-4H3;3-8H,9-13H2,1-2H3;3-10H,11-12H2,1-2H3,(H2,25,31);5-12H,13H2,1-4H3;5-12H,13H2,1-4H3;3-10,25H,11H2,1-2H3;3-9H,10H2,1-2H3
InChIKeyNFSXLDKBILAEJD-UHFFFAOYSA-N
XLogP34.38
TPSA873.11 Ų
H-Bond Donors2
H-Bond Acceptors75
Rotatable Bonds64
Heavy Atoms284
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003888.01
LogP ≤ 534.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1075

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole with MolForge

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Related Compounds

3-(3-hydroxyphenyl)-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-hydroxy-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-(2-morpholin-4-ylethoxy)-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]benzamide;3-phenylmethoxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-[3-[[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]carbamoyl]phenyl]benzoic acid;N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-2,3-dihydro-1-benzofuran-5-carboxamide;N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-yl]benzamide
CID 157860152
3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[3-(1-methylpiperidin-4-yl)oxyphenyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[[2-(2-methylpropoxy)-4-pyridinyl]methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylpropan-1-amine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;4-[3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]phenyl]morpholine;3-[5-methyl-1-[[3-(4-methylpiperazin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-5-(4-methylphenyl)-1,2,4-oxadiazole
CID 158273204
7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(difluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(4-fluoro-3-methylphenyl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 158385513
CID 158503868
CID 158503868
5-(1-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)-3-(4-methylphenyl)-1,2,4-oxadiazole;5-(1-benzyl-5-ethyl-1,2,4-triazol-3-yl)-3-(4-methylphenyl)-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[(2-ethyl-4-pyridinyl)methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[2-(4-methoxybutyl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylpyridin-2-amine;4-[3-[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]propyl]morpholine;N-[2-(dimethylamino)ethyl]-3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]benzamide;methane;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
CID 158568748
5-(1-Benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)-3-(4-methylphenyl)-1,2,4-oxadiazole;2-[1-[[2-(4,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-5-phenyl-1,3,4-oxadiazole;methane;1-methyl-4-[4-[[5-methyl-3-(5-phenylfuran-2-yl)-1,2,4-triazol-1-yl]methyl]-2-pyridinyl]piperazine;5-[5-methyl-1-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-1,2,4-triazol-3-yl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-[5-methyl-1-[[3-(4-methylpiperidin-1-yl)phenyl]methyl]-1,2,4-triazol-3-yl]-5-(4-methylphenyl)-1,3,4-oxadiazole;2-[5-methyl-1-[[2-(4-methylpiperidin-1-yl)-4-pyridinyl]methyl]-1,2,4-triazol-3-yl]-5-(4-methylphenyl)-1,3,4-oxadiazole;3-(4-methylphenyl)-5-[5-methyl-1-[(2-piperazin-1-yl-4-pyridinyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;tetrakis(2,2,2-trifluoroacetic acid)
CID 158865023
3-(cyclohexen-1-yl)-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(dimethylcarbamoyl)phenyl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;methyl 3-[3-[[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]carbamoyl]phenyl]benzoate;3-phenyl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-3-pyrimidin-5-ylbenzamide;N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-3-(2-pyrrolidin-1-ylethoxy)benzamide;N-[5-[5-pyridin-3-yl-3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-yl]benzamide
CID 159277482
CID 159324466
CID 159324466
3-tert-butylaniline;4-tert-butylbenzamide;5-tert-butyl-2-cyclopropylpyrimidine;3-tert-butyl-1-(difluoromethyl)pyrazole;5-tert-butyl-1-ethylpyrazole;1-tert-butyl-4-methoxybenzene;2-tert-butyl-6-methoxypyridine;3-tert-butyl-5-methoxypyridine;4-tert-butyl-2-methoxypyrimidine;5-tert-butyl-2-methoxypyrimidine;1-tert-butyl-2-methylbenzene;5-tert-butyl-1-methylimidazole;3-tert-butyl-3-methyloxetane;4-tert-butyl-1-methylpyrazole;3-tert-butyl-4-methyl-1,2,4-triazole;N-(3-tert-butylphenyl)acetamide;3-tert-butyl-5-propan-2-yl-1,2,4-oxadiazole;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yloxypyridine;2-tert-butyl-7-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 159470779
CID 160244635
CID 160244635
CID 160299745
CID 160299745
CID 160440886
CID 160440886

Frequently Asked Questions

What is the IUPAC name of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole?
The IUPAC name of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole (CID 159767939) is 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole.
What is the SMILES notation for 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole?
The canonical SMILES for 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole is COCCCCc1cccc(Cn2nc(-c3nc(-c4ccc(OC(C)(F)F)cc4)no3)nc2C)c1.Cc1ccc(-c2nc(-c3nc(C)n(Cc4cccc(N(C)C)c4)n3)no2)cc1.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cccc(O)c4)n3)n2)cc1.Cc1ccc(-c2noc(-c3nc(C)n(Cc4cnccn4)n3)n2)cc1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(N(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OC(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OCC(=O)N(C)C)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1cccc(OCC(N)=O)c1.Cc1nc(-c2nc(-c3ccc(OC(C)(F)F)cc3)no2)nn1Cc1ccnc(N2CCOCC2)n1.
What is the InChIKey of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole?
The InChIKey is NFSXLDKBILAEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27F2N5O3.C24H24F2N6O4.C23H23F2N5O3.C22H22F2N8O3.C22H20F2N6O4.C22H22F2N6O2.C21H22N6O.C19H17N5O2.C17H15N7O/c1-17-28-23(30-32(17)16-19-9-6-8-18(15-19)7-4-5-14-33-3)24-29-22(31-35-24)20-10-12-21(13-11-20)34-25(2,26)27;1-15-27-22(23-28-21(30-36-23)17-8-10-18(11-9-17)35-24(2,25)26)29-32(15)13-16-6-5-7-19(12-16)34-14-20(33)31(3)4;1-14(2)31-19-7-5-6-16(12-19)13-30-15(3)26-21(28-30)22-27-20(29-33-22)17-8-10-18(11-9-17)32-23(4,24)25;1-14-26-19(20-28-18(30-35-20)15-3-5-17(6-4-15)34-22(2,23)24)29-32(14)13-16-7-8-25-21(27-16)31-9-11-33-12-10-31;1-13-26-20(28-30(13)11-14-4-3-5-17(10-14)32-12-18(25)31)21-27-19(29-34-21)15-6-8-16(9-7-15)33-22(2,23)24;1-14-25-20(27-30(14)13-15-6-5-7-17(12-15)29(3)4)21-26-19(28-32-21)16-8-10-18(11-9-16)31-22(2,23)24;1-14-8-10-17(11-9-14)21-23-20(25-28-21)19-22-15(2)27(24-19)13-16-6-5-7-18(12-16)26(3)4;1-12-6-8-15(9-7-12)17-21-19(26-23-17)18-20-13(2)24(22-18)11-14-4-3-5-16(25)10-14;1-11-3-5-13(6-4-11)15-21-17(25-23-15)16-20-12(2)24(22-16)10-14-9-18-7-8-19-14/h6,8-13,15H,4-5,7,14,16H2,1-3H3;5-12H,13-14H2,1-4H3;5-12,14H,13H2,1-4H3;3-8H,9-13H2,1-2H3;3-10H,11-12H2,1-2H3,(H2,25,31);5-12H,13H2,1-4H3;5-12H,13H2,1-4H3;3-10,25H,11H2,1-2H3;3-9H,10H2,1-2H3.
What are the key properties of 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole?
3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole has a molecular weight of 3888.01 g/mol, XLogP of 34.38, 64 rotatable bonds, 2 hydrogen bond donors, and 75 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(1,1-difluoroethoxy)phenyl]-5-[1-[[3-(4-methoxybutyl)phenyl]methyl]-5-methyl-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[4-(1,1-difluoroethoxy)phenyl]-5-[5-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-1,2,4-triazol-3-yl]-1,2,4-oxadiazole;3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]-N,N-dimethylaniline;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]acetamide;2-[3-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]phenoxy]-N,N-dimethylacetamide;4-[4-[[3-[3-[4-(1,1-difluoroethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-5-methyl-1,2,4-triazol-1-yl]methyl]pyrimidin-2-yl]morpholine;N,N-dimethyl-3-[[5-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,4-triazol-1-yl]methyl]aniline;3-[[5-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-triazol-1-yl]methyl]phenol;3-(4-methylphenyl)-5-[5-methyl-1-(pyrazin-2-ylmethyl)-1,2,4-triazol-3-yl]-1,2,4-oxadiazole is sourced from PubChem (CID 159767939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).