2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane

C195H150N18O3SSi2 — CID 158933178

IUPAC2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane
SMILESCC(C)(C)c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1.CCC(C)Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5sc6ccc(-c7cccc(-n8c9ccccc9c9ccccc98)c7)cc6c5c4)ccc32)c1.C[Si]1(C)C(c2ccc(-c3ccccn3)nc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-c2ccccn2)nc1.Cc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.c1ccc(-c2ccc(-c3nnc(-c4cccc(-c5nnc(-c6ccc(-c7ccccn7)nc6)o5)c4)o3)cn2)nc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C53H40N2S.C38H30N4Si.C30H18N8O2.C26H20N2.C24H22N2O.C24H20Si/c1-3-34(2)28-35-12-10-14-40(29-35)54-50-21-9-6-18-44(50)45-31-37(22-25-51(45)54)39-24-27-53-47(33-39)46-32-38(23-26-52(46)56-53)36-13-11-15-41(30-36)55-48-19-7-4-16-42(48)43-17-5-8-20-49(43)55;1-43(2)37(29-19-21-33(41-25-29)31-17-9-11-23-39-31)35(27-13-5-3-6-14-27)36(28-15-7-4-8-16-28)38(43)30-20-22-34(42-26-30)32-18-10-12-24-40-32;1-3-14-31-23(8-1)25-12-10-21(17-33-25)29-37-35-27(39-29)19-6-5-7-20(16-19)28-36-38-30(40-28)22-11-13-26(34-18-22)24-9-2-4-15-32-24;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;1-24(2,3)21-15-13-20(14-16-21)23-26-25-22(27-23)19-11-9-18(10-12-19)17-7-5-4-6-8-17;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h4-27,29-34H,3,28H2,1-2H3;3-26H,1-2H3;1-18H;3-16H,1-2H3;4-16H,1-3H3;1-20H
InChIKeyJJHZPHIUROEGOG-UHFFFAOYSA-N
MW2881.71 g/mol
LogP46.29
Rot. Bonds28

About 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane

2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane (PubChem CID 158933178) has the molecular formula C195H150N18O3SSi2 and a molecular weight of 2881.71 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane
PubChem CID158933178
Molecular FormulaC195H150N18O3SSi2
Molecular Weight2881.71 g/mol
Exact Mass2879.14
IUPAC Name2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane
SMILESCC(C)(C)c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1.CCC(C)Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5sc6ccc(-c7cccc(-n8c9ccccc9c9ccccc98)c7)cc6c5c4)ccc32)c1.C[Si]1(C)C(c2ccc(-c3ccccn3)nc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-c2ccccn2)nc1.Cc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.c1ccc(-c2ccc(-c3nnc(-c4cccc(-c5nnc(-c6ccc(-c7ccccn7)nc6)o5)c4)o3)cn2)nc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C53H40N2S.C38H30N4Si.C30H18N8O2.C26H20N2.C24H22N2O.C24H20Si/c1-3-34(2)28-35-12-10-14-40(29-35)54-50-21-9-6-18-44(50)45-31-37(22-25-51(45)54)39-24-27-53-47(33-39)46-32-38(23-26-52(46)56-53)36-13-11-15-41(30-36)55-48-19-7-4-16-42(48)43-17-5-8-20-49(43)55;1-43(2)37(29-19-21-33(41-25-29)31-17-9-11-23-39-31)35(27-13-5-3-6-14-27)36(28-15-7-4-8-16-28)38(43)30-20-22-34(42-26-30)32-18-10-12-24-40-32;1-3-14-31-23(8-1)25-12-10-21(17-33-25)29-37-35-27(39-29)19-6-5-7-20(16-19)28-36-38-30(40-28)22-11-13-26(34-18-22)24-9-2-4-15-32-24;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;1-24(2,3)21-15-13-20(14-16-21)23-26-25-22(27-23)19-11-9-18(10-12-19)17-7-5-4-6-8-17;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h4-27,29-34H,3,28H2,1-2H3;3-26H,1-2H3;1-18H;3-16H,1-2H3;4-16H,1-3H3;1-20H
InChIKeyJJHZPHIUROEGOG-UHFFFAOYSA-N
XLogP46.29
TPSA255.52 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds28
Heavy Atoms219
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002881.71
LogP ≤ 546.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane?
The IUPAC name of 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane (CID 158933178) is 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane.
What is the SMILES notation for 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane?
The canonical SMILES for 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane is CC(C)(C)c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1.CCC(C)Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5sc6ccc(-c7cccc(-n8c9ccccc9c9ccccc98)c7)cc6c5c4)ccc32)c1.C[Si]1(C)C(c2ccc(-c3ccccn3)nc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-c2ccccn2)nc1.Cc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.c1ccc(-c2ccc(-c3nnc(-c4cccc(-c5nnc(-c6ccc(-c7ccccn7)nc6)o5)c4)o3)cn2)nc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane?
The InChIKey is JJHZPHIUROEGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H40N2S.C38H30N4Si.C30H18N8O2.C26H20N2.C24H22N2O.C24H20Si/c1-3-34(2)28-35-12-10-14-40(29-35)54-50-21-9-6-18-44(50)45-31-37(22-25-51(45)54)39-24-27-53-47(33-39)46-32-38(23-26-52(46)56-53)36-13-11-15-41(30-36)55-48-19-7-4-16-42(48)43-17-5-8-20-49(43)55;1-43(2)37(29-19-21-33(41-25-29)31-17-9-11-23-39-31)35(27-13-5-3-6-14-27)36(28-15-7-4-8-16-28)38(43)30-20-22-34(42-26-30)32-18-10-12-24-40-32;1-3-14-31-23(8-1)25-12-10-21(17-33-25)29-37-35-27(39-29)19-6-5-7-20(16-19)28-36-38-30(40-28)22-11-13-26(34-18-22)24-9-2-4-15-32-24;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;1-24(2,3)21-15-13-20(14-16-21)23-26-25-22(27-23)19-11-9-18(10-12-19)17-7-5-4-6-8-17;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h4-27,29-34H,3,28H2,1-2H3;3-26H,1-2H3;1-18H;3-16H,1-2H3;4-16H,1-3H3;1-20H.
What are the key properties of 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane?
2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane has a molecular weight of 2881.71 g/mol, XLogP of 46.29, 28 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-[8-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]-9-[3-(2-methylbutyl)phenyl]carbazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole;tetraphenylsilane is sourced from PubChem (CID 158933178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).