2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole

C245H146F12N48O12 — CID 160542161

IUPAC2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
SMILESCc1ccnc2c1ccc1c(C(F)(F)F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C(F)(F)F)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.Cc1ccnc2c1ccc1c(C)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.Cc1ccnc2c1ccc1c(F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(F)c7ccc8c(F)ccnc8c7n6)o5)c4)o3)nc12.Cc1cnc2c(ccc3c(C)c(C)c(-c4nnc(-c5cccc(-c6nnc(-c7nc8c(ccc9c(C)c(C)cnc98)c(C(F)(F)F)c7C)o6)c5)o4)nc32)c1C.c1cc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)o2)cc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)o2)c1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)cc(-c4nnc(-c5cccc(-c6nnc(-c7cc(-c8ccccc8)c8ccc9c(-c%10ccccc%10)ccnc9c8n7)o6)c5)o4)nc23)cc1
InChIInChI=1S/C58H34N8O2.C42H31F3N8O2.C38H20F6N8O2.C38H26N8O2.C35H17F3N8O2.C34H18N8O2/c1-5-14-35(15-6-1)41-28-30-59-51-43(41)24-26-45-47(37-18-9-3-10-19-37)33-49(61-53(45)51)57-65-63-55(67-57)39-22-13-23-40(32-39)56-64-66-58(68-56)50-34-48(38-20-11-4-12-21-38)46-27-25-44-42(36-16-7-2-8-17-36)29-31-60-52(44)54(46)62-50;1-18-16-46-34-27(20(18)3)11-12-29-22(5)23(6)32(48-36(29)34)40-52-50-38(54-40)25-9-8-10-26(15-25)39-51-53-41(55-39)33-24(7)31(42(43,44)45)30-14-13-28-21(4)19(2)17-47-35(28)37(30)49-33;1-17-10-12-45-29-21(17)6-8-23-25(37(39,40)41)15-27(47-31(23)29)35-51-49-33(53-35)19-4-3-5-20(14-19)34-50-52-36(54-34)28-16-26(38(42,43)44)24-9-7-22-18(2)11-13-46-30(22)32(24)48-28;1-19-12-14-39-31-25(19)8-10-27-21(3)16-29(41-33(27)31)37-45-43-35(47-37)23-6-5-7-24(18-23)36-44-46-38(48-36)30-17-22(4)28-11-9-26-20(2)13-15-40-32(26)34(28)42-30;1-16-9-11-39-28-19(16)5-6-21-24(37)14-26(41-30(21)28)34-45-43-32(47-34)17-3-2-4-18(13-17)33-44-46-35(48-33)27-15-25(38)22-8-7-20-23(36)10-12-40-29(20)31(22)42-27;1-4-23(31-39-41-33(43-31)25-14-12-21-10-8-19-6-2-16-35-27(19)29(21)37-25)18-24(5-1)32-40-42-34(44-32)26-15-13-22-11-9-20-7-3-17-36-28(20)30(22)38-26/h1-34H;8-17H,1-7H3;3-16H,1-2H3;5-18H,1-4H3;2-15H,1H3;1-18H
InChIKeyQWXUEYDQMIKDBN-UHFFFAOYSA-N
MW4182.16 g/mol
LogP58.34
Rot. Bonds28

About 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole

2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole (PubChem CID 160542161) has the molecular formula C245H146F12N48O12 and a molecular weight of 4182.16 g/mol. Its IUPAC name is 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
PubChem CID160542161
Molecular FormulaC245H146F12N48O12
Molecular Weight4182.16 g/mol
Exact Mass4179.21
IUPAC Name2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
SMILESCc1ccnc2c1ccc1c(C(F)(F)F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C(F)(F)F)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.Cc1ccnc2c1ccc1c(C)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.Cc1ccnc2c1ccc1c(F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(F)c7ccc8c(F)ccnc8c7n6)o5)c4)o3)nc12.Cc1cnc2c(ccc3c(C)c(C)c(-c4nnc(-c5cccc(-c6nnc(-c7nc8c(ccc9c(C)c(C)cnc98)c(C(F)(F)F)c7C)o6)c5)o4)nc32)c1C.c1cc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)o2)cc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)o2)c1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)cc(-c4nnc(-c5cccc(-c6nnc(-c7cc(-c8ccccc8)c8ccc9c(-c%10ccccc%10)ccnc9c8n7)o6)c5)o4)nc23)cc1
InChIInChI=1S/C58H34N8O2.C42H31F3N8O2.C38H20F6N8O2.C38H26N8O2.C35H17F3N8O2.C34H18N8O2/c1-5-14-35(15-6-1)41-28-30-59-51-43(41)24-26-45-47(37-18-9-3-10-19-37)33-49(61-53(45)51)57-65-63-55(67-57)39-22-13-23-40(32-39)56-64-66-58(68-56)50-34-48(38-20-11-4-12-21-38)46-27-25-44-42(36-16-7-2-8-17-36)29-31-60-52(44)54(46)62-50;1-18-16-46-34-27(20(18)3)11-12-29-22(5)23(6)32(48-36(29)34)40-52-50-38(54-40)25-9-8-10-26(15-25)39-51-53-41(55-39)33-24(7)31(42(43,44)45)30-14-13-28-21(4)19(2)17-47-35(28)37(30)49-33;1-17-10-12-45-29-21(17)6-8-23-25(37(39,40)41)15-27(47-31(23)29)35-51-49-33(53-35)19-4-3-5-20(14-19)34-50-52-36(54-34)28-16-26(38(42,43)44)24-9-7-22-18(2)11-13-46-30(22)32(24)48-28;1-19-12-14-39-31-25(19)8-10-27-21(3)16-29(41-33(27)31)37-45-43-35(47-37)23-6-5-7-24(18-23)36-44-46-38(48-36)30-17-22(4)28-11-9-26-20(2)13-15-40-32(26)34(28)42-30;1-16-9-11-39-28-19(16)5-6-21-24(37)14-26(41-30(21)28)34-45-43-32(47-34)17-3-2-4-18(13-17)33-44-46-35(48-33)27-15-25(38)22-8-7-20-23(36)10-12-40-29(20)31(22)42-27;1-4-23(31-39-41-33(43-31)25-14-12-21-10-8-19-6-2-16-35-27(19)29(21)37-25)18-24(5-1)32-40-42-34(44-32)26-15-13-22-11-9-20-7-3-17-36-28(20)30(22)38-26/h1-34H;8-17H,1-7H3;3-16H,1-2H3;5-18H,1-4H3;2-15H,1H3;1-18H
InChIKeyQWXUEYDQMIKDBN-UHFFFAOYSA-N
XLogP58.34
TPSA776.40 Ų
H-Bond Donors
H-Bond Acceptors60
Rotatable Bonds28
Heavy Atoms317
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004182.16
LogP ≤ 558.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1060

Analyze 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole with MolForge

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Related Compounds

2,6-Bis[2-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-5-yl]pyridine
CID 57865067
2-[5-(Trifluoromethyl)quinoxalin-2-yl]-5-[3-[5-[5-(trifluoromethyl)quinoxalin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 57865046
2-[8-(Trifluoromethyl)quinoxalin-2-yl]-5-[3-[5-[8-(trifluoromethyl)quinoxalin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 57865050
2-(4,7-Difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-difluoro-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 57865073
2-[4,7-Bis(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[4,7-bis(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 57865130
2-(3,4,7,8-Tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 68188065
2-(4,7-Difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 68188066
2-[7-Methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 88864519
2-[3,5-Bis[3-(4-tert-butylphenyl)quinoxalin-2-yl]phenyl]-3-(4-tert-butylphenyl)quinoxaline;2-[3,5-bis(3-phenylquinoxalin-2-yl)phenyl]-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;hexakis(1,1,1-trifluoroethane);tri(quinolin-8-yloxy)alumane
CID 157078417
2-(3-Fluoroquinolin-2-yl)-5-[3-[5-(3-fluoroquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(6-fluoroquinolin-2-yl)-5-[3-[5-(6-methylquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(7-fluoroquinolin-2-yl)-5-[3-[5-(7-methylquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;methane;bis(2-(6-methylquinolin-2-yl)-5-[3-[5-(6-methylquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole);bis(2-(7-methylquinolin-2-yl)-5-[3-[5-(7-methylquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole);2-(3-methylquinolin-2-yl)-5-[3-[5-[3-(trifluoromethyl)quinolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3-phenylquinolin-2-yl)-5-[3-[5-(3-phenylquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(6-phenylquinolin-2-yl)-5-[3-[5-(6-phenylquinolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 157155134
2-(6-Fluoroquinolin-3-yl)-5-[3-[5-(6-fluoroquinolin-3-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(7-fluoroquinolin-3-yl)-5-[3-[5-(7-fluoroquinolin-3-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(6-methylquinolin-3-yl)-5-[3-[5-(6-methylquinolin-3-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(7-methylquinolin-3-yl)-5-[3-[5-(7-methylquinolin-3-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(7-phenylquinolin-3-yl)-5-[3-[5-(7-phenylquinolin-3-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-quinolin-3-yl-5-[3-(5-quinolin-3-yl-1,3,4-oxadiazol-2-yl)phenyl]-1,3,4-oxadiazole;2-[7-(trifluoromethyl)quinolin-3-yl]-5-[3-[5-[7-(trifluoromethyl)quinolin-3-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 157294338
2-[3,5-Bis[3-(4-tert-butylphenyl)quinoxalin-2-yl]phenyl]-3-(4-tert-butylphenyl)quinoxaline;2-[3,5-bis(3-phenylquinoxalin-2-yl)phenyl]-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;4,7-diphenyl-1,10-phenanthroline;hexakis(1,1,1-trifluoroethane);tri(quinolin-8-yloxy)alumane
CID 158237148

Frequently Asked Questions

What is the IUPAC name of 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
The IUPAC name of 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole (CID 160542161) is 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole is Cc1ccnc2c1ccc1c(C(F)(F)F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C(F)(F)F)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.Cc1ccnc2c1ccc1c(C)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.Cc1ccnc2c1ccc1c(F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(F)c7ccc8c(F)ccnc8c7n6)o5)c4)o3)nc12.Cc1cnc2c(ccc3c(C)c(C)c(-c4nnc(-c5cccc(-c6nnc(-c7nc8c(ccc9c(C)c(C)cnc98)c(C(F)(F)F)c7C)o6)c5)o4)nc32)c1C.c1cc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)o2)cc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)o2)c1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)cc(-c4nnc(-c5cccc(-c6nnc(-c7cc(-c8ccccc8)c8ccc9c(-c%10ccccc%10)ccnc9c8n7)o6)c5)o4)nc23)cc1.
What is the InChIKey of 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
The InChIKey is QWXUEYDQMIKDBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H34N8O2.C42H31F3N8O2.C38H20F6N8O2.C38H26N8O2.C35H17F3N8O2.C34H18N8O2/c1-5-14-35(15-6-1)41-28-30-59-51-43(41)24-26-45-47(37-18-9-3-10-19-37)33-49(61-53(45)51)57-65-63-55(67-57)39-22-13-23-40(32-39)56-64-66-58(68-56)50-34-48(38-20-11-4-12-21-38)46-27-25-44-42(36-16-7-2-8-17-36)29-31-60-52(44)54(46)62-50;1-18-16-46-34-27(20(18)3)11-12-29-22(5)23(6)32(48-36(29)34)40-52-50-38(54-40)25-9-8-10-26(15-25)39-51-53-41(55-39)33-24(7)31(42(43,44)45)30-14-13-28-21(4)19(2)17-47-35(28)37(30)49-33;1-17-10-12-45-29-21(17)6-8-23-25(37(39,40)41)15-27(47-31(23)29)35-51-49-33(53-35)19-4-3-5-20(14-19)34-50-52-36(54-34)28-16-26(38(42,43)44)24-9-7-22-18(2)11-13-46-30(22)32(24)48-28;1-19-12-14-39-31-25(19)8-10-27-21(3)16-29(41-33(27)31)37-45-43-35(47-37)23-6-5-7-24(18-23)36-44-46-38(48-36)30-17-22(4)28-11-9-26-20(2)13-15-40-32(26)34(28)42-30;1-16-9-11-39-28-19(16)5-6-21-24(37)14-26(41-30(21)28)34-45-43-32(47-34)17-3-2-4-18(13-17)33-44-46-35(48-33)27-15-25(38)22-8-7-20-23(36)10-12-40-29(20)31(22)42-27;1-4-23(31-39-41-33(43-31)25-14-12-21-10-8-19-6-2-16-35-27(19)29(21)37-25)18-24(5-1)32-40-42-34(44-32)26-15-13-22-11-9-20-7-3-17-36-28(20)30(22)38-26/h1-34H;8-17H,1-7H3;3-16H,1-2H3;5-18H,1-4H3;2-15H,1H3;1-18H.
What are the key properties of 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole has a molecular weight of 4182.16 g/mol, XLogP of 58.34, 28 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,7-difluoro-1,10-phenanthrolin-2-yl)-5-[3-[5-(4-fluoro-7-methyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-dimethyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-5-[3-[5-(4,7-diphenyl-1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-5-[3-[5-[7-methyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;2-(3,4,7,8-tetramethyl-1,10-phenanthrolin-2-yl)-5-[3-[5-[3,7,8-trimethyl-4-(trifluoromethyl)-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole is sourced from PubChem (CID 160542161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).