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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole

C202H106F16N40O10 — CID 159281961

IUPAC2-[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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
SMILESCc1ccnc2c1ccc1c(C)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.FC(F)(F)c1ccnc2c1ccc1c(C(F)(F)F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C(F)(F)F)c7ccc8c(C(F)(F)F)ccnc8c7n6)o5)c4)o3)nc12.Fc1ccnc2c1ccc1c(F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(F)c7ccc8c(F)ccnc8c7n6)o5)c4)o3)nc12.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.C38H14F12N8O2.C38H26N8O2.C34H14F4N8O2.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;39-35(40,41)21-8-10-51-27-17(21)4-6-19-23(37(45,46)47)13-25(53-29(19)27)33-57-55-31(59-33)15-2-1-3-16(12-15)32-56-58-34(60-32)26-14-24(38(48,49)50)20-7-5-18-22(36(42,43)44)9-11-52-28(18)30(20)54-26;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;35-21-8-10-39-27-17(21)4-6-19-23(37)13-25(41-29(19)27)33-45-43-31(47-33)15-2-1-3-16(12-15)32-44-46-34(48-32)26-14-24(38)20-7-5-18-22(36)9-11-40-28(18)30(20)42-26;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;1-14H;5-18H,1-4H3;1-14H;1-18H
InChIKeyKZAJZPMIMOQUTO-UHFFFAOYSA-N
MW3557.31 g/mol
LogP49.10
Rot. Bonds24

About 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;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;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-(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-[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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole (PubChem CID 159281961) has the molecular formula C202H106F16N40O10 and a molecular weight of 3557.31 g/mol. Its IUPAC name is 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
PubChem CID159281961
Molecular FormulaC202H106F16N40O10
Molecular Weight3557.31 g/mol
Exact Mass3554.88
IUPAC Name2-[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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
SMILESCc1ccnc2c1ccc1c(C)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.FC(F)(F)c1ccnc2c1ccc1c(C(F)(F)F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C(F)(F)F)c7ccc8c(C(F)(F)F)ccnc8c7n6)o5)c4)o3)nc12.Fc1ccnc2c1ccc1c(F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(F)c7ccc8c(F)ccnc8c7n6)o5)c4)o3)nc12.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.C38H14F12N8O2.C38H26N8O2.C34H14F4N8O2.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;39-35(40,41)21-8-10-51-27-17(21)4-6-19-23(37(45,46)47)13-25(53-29(19)27)33-57-55-31(59-33)15-2-1-3-16(12-15)32-56-58-34(60-32)26-14-24(38(48,49)50)20-7-5-18-22(36(42,43)44)9-11-52-28(18)30(20)54-26;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;35-21-8-10-39-27-17(21)4-6-19-23(37)13-25(41-29(19)27)33-45-43-31(47-33)15-2-1-3-16(12-15)32-44-46-34(48-32)26-14-24(38)20-7-5-18-22(36)9-11-40-28(18)30(20)42-26;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;1-14H;5-18H,1-4H3;1-14H;1-18H
InChIKeyKZAJZPMIMOQUTO-UHFFFAOYSA-N
XLogP49.10
TPSA647.00 Ų
H-Bond Donors
H-Bond Acceptors50
Rotatable Bonds24
Heavy Atoms268
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003557.31
LogP ≤ 549.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1050

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
The IUPAC name of 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole (CID 159281961) is 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(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-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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
The canonical SMILES for 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole is Cc1ccnc2c1ccc1c(C)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C)c7ccc8c(C)ccnc8c7n6)o5)c4)o3)nc12.FC(F)(F)c1ccnc2c1ccc1c(C(F)(F)F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(C(F)(F)F)c7ccc8c(C(F)(F)F)ccnc8c7n6)o5)c4)o3)nc12.Fc1ccnc2c1ccc1c(F)cc(-c3nnc(-c4cccc(-c5nnc(-c6cc(F)c7ccc8c(F)ccnc8c7n6)o5)c4)o3)nc12.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-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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?
The InChIKey is KZAJZPMIMOQUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H34N8O2.C38H14F12N8O2.C38H26N8O2.C34H14F4N8O2.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;39-35(40,41)21-8-10-51-27-17(21)4-6-19-23(37(45,46)47)13-25(53-29(19)27)33-57-55-31(59-33)15-2-1-3-16(12-15)32-56-58-34(60-32)26-14-24(38(48,49)50)20-7-5-18-22(36(42,43)44)9-11-52-28(18)30(20)54-26;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;35-21-8-10-39-27-17(21)4-6-19-23(37)13-25(41-29(19)27)33-45-43-31(47-33)15-2-1-3-16(12-15)32-44-46-34(48-32)26-14-24(38)20-7-5-18-22(36)9-11-40-28(18)30(20)42-26;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;1-14H;5-18H,1-4H3;1-14H;1-18H.
What are the key properties of 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;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;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-(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-[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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole has a molecular weight of 3557.31 g/mol, XLogP of 49.10, 24 rotatable bonds, 0 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 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;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;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-(1,10-phenanthrolin-2-yl)-5-[3-[5-(1,10-phenanthrolin-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole is sourced from PubChem (CID 159281961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).