6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine

C354H262N14O4Si8 — CID 157454663

IUPAC6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESCC(C)(C)c1cccc2c1oc1c(-c3cc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cc(-c4cccc5c4oc4c(C(C)(C)C)cccc45)c3)cccc12.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)c(-c4ccc5c(c4)-c4ccccc4[Si]5(C)C)c3)ccc21.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cc3-c3ccc4c(c3)-c3ccccc3[Si]4(C)C)ccc21.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4ccc5c(c4)-c4ccccc4[Si]5(C)C)c(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)c3)ccc21.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc([Si]6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)cc(-c5ccc([Si]6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)c4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc6oc7ncccc7c6c5)cc(-c5ccc6oc7ncccc7c6c5)c4)nc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C76H52N2Si2.C60H48N2O2.3C56H44N2Si2.C50H30N4O2/c1-5-21-53(22-6-1)54-37-39-57(40-38-54)70-52-71(78-76(77-70)58-23-7-2-8-24-58)61-50-59(55-41-45-64(46-42-55)79(62-25-9-3-10-26-62)72-33-17-13-29-66(72)67-30-14-18-34-73(67)79)49-60(51-61)56-43-47-65(48-44-56)80(63-27-11-4-12-28-63)74-35-19-15-31-68(74)69-32-16-20-36-75(69)80;1-59(2,3)50-27-15-25-48-46-23-13-21-44(54(46)63-56(48)50)41-33-42(45-22-14-24-47-49-26-16-28-51(60(4,5)6)57(49)64-55(45)47)35-43(34-41)53-36-52(61-58(62-53)40-19-11-8-12-20-40)39-31-29-38(30-32-39)37-17-9-7-10-18-37;1-59(2)52-21-13-11-19-45(52)48-33-41(28-31-54(48)59)44-30-27-43(35-47(44)42-29-32-55-49(34-42)46-20-12-14-22-53(46)60(55,3)4)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-59(2)52-21-13-11-19-45(52)48-34-42(28-31-54(48)59)41-27-30-44(47(33-41)43-29-32-55-49(35-43)46-20-12-14-22-53(46)60(55,3)4)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-59(2)52-21-13-11-19-45(52)48-34-42(28-31-54(48)59)41-27-30-44(43-29-32-55-49(35-43)46-20-12-14-22-53(46)60(55,3)4)47(33-41)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-3-9-31(10-4-1)32-15-17-33(18-16-32)44-30-45(54-48(53-44)34-11-5-2-6-12-34)39-26-37(35-19-21-46-42(28-35)40-13-7-23-51-49(40)55-46)25-38(27-39)36-20-22-47-43(29-36)41-14-8-24-52-50(41)56-47/h1-52H;7-36H,1-6H3;3*5-36H,1-4H3;1-30H
InChIKeyBTFFIJLIMFCVQN-UHFFFAOYSA-N
MW5000.77 g/mol
LogP79.39
Rot. Bonds40

About 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine

6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine (PubChem CID 157454663) has the molecular formula C354H262N14O4Si8 and a molecular weight of 5000.77 g/mol. Its IUPAC name is 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

Compound Name6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
PubChem CID157454663
Molecular FormulaC354H262N14O4Si8
Molecular Weight5000.77 g/mol
Exact Mass4995.89
IUPAC Name6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESCC(C)(C)c1cccc2c1oc1c(-c3cc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cc(-c4cccc5c4oc4c(C(C)(C)C)cccc45)c3)cccc12.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)c(-c4ccc5c(c4)-c4ccccc4[Si]5(C)C)c3)ccc21.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cc3-c3ccc4c(c3)-c3ccccc3[Si]4(C)C)ccc21.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4ccc5c(c4)-c4ccccc4[Si]5(C)C)c(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)c3)ccc21.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc([Si]6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)cc(-c5ccc([Si]6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)c4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc6oc7ncccc7c6c5)cc(-c5ccc6oc7ncccc7c6c5)c4)nc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C76H52N2Si2.C60H48N2O2.3C56H44N2Si2.C50H30N4O2/c1-5-21-53(22-6-1)54-37-39-57(40-38-54)70-52-71(78-76(77-70)58-23-7-2-8-24-58)61-50-59(55-41-45-64(46-42-55)79(62-25-9-3-10-26-62)72-33-17-13-29-66(72)67-30-14-18-34-73(67)79)49-60(51-61)56-43-47-65(48-44-56)80(63-27-11-4-12-28-63)74-35-19-15-31-68(74)69-32-16-20-36-75(69)80;1-59(2,3)50-27-15-25-48-46-23-13-21-44(54(46)63-56(48)50)41-33-42(45-22-14-24-47-49-26-16-28-51(60(4,5)6)57(49)64-55(45)47)35-43(34-41)53-36-52(61-58(62-53)40-19-11-8-12-20-40)39-31-29-38(30-32-39)37-17-9-7-10-18-37;1-59(2)52-21-13-11-19-45(52)48-33-41(28-31-54(48)59)44-30-27-43(35-47(44)42-29-32-55-49(34-42)46-20-12-14-22-53(46)60(55,3)4)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-59(2)52-21-13-11-19-45(52)48-34-42(28-31-54(48)59)41-27-30-44(47(33-41)43-29-32-55-49(35-43)46-20-12-14-22-53(46)60(55,3)4)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-59(2)52-21-13-11-19-45(52)48-34-42(28-31-54(48)59)41-27-30-44(43-29-32-55-49(35-43)46-20-12-14-22-53(46)60(55,3)4)47(33-41)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-3-9-31(10-4-1)32-15-17-33(18-16-32)44-30-45(54-48(53-44)34-11-5-2-6-12-34)39-26-37(35-19-21-46-42(28-35)40-13-7-23-51-49(40)55-46)25-38(27-39)36-20-22-47-43(29-36)41-14-8-24-52-50(41)56-47/h1-52H;7-36H,1-6H3;3*5-36H,1-4H3;1-30H
InChIKeyBTFFIJLIMFCVQN-UHFFFAOYSA-N
XLogP79.39
TPSA233.02 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds40
Heavy Atoms380
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005000.77
LogP ≤ 579.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine with MolForge

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Related Compounds

4-[4-[8-[4-[2-[4-[3-(6-Fluoro-[1]benzofuro[2,3-c]pyridin-1-yl)phenyl]-6-pyridin-2-yl-[1]benzofuro[3,2-b]pyridin-8-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-d]pyrimidine
CID 142336487
2-[3,5-Di(dibenzofuran-2-yl)phenyl]-4-(6-fluoro-3-pyridinyl)-6-(2-pyridin-3-ylphenyl)pyrimidine
CID 155129287
8-[7-(Cyclopentylmethyl)-3-methylquinazolin-3-ium-4-yl]-2,5-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;8-(7-cyclopentyl-3-methylquinazolin-3-ium-4-yl)-2,5-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2,5-difluoro-6,7-dimethyl-8-[3-methyl-7-(3,3,3-trifluoro-2,2-dimethylpropyl)quinazolin-3-ium-4-yl]-[1]benzofuro[2,3-b]pyridine;8-[7-(2,2-dimethylpropyl)-3-methylquinazolin-3-ium-4-yl]-2,5-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine
CID 157259282
8-(7-Cyclopentyl-3-methylquinazolin-3-ium-4-yl)-2,4-difluoro-7-methyl-[1]benzofuro[2,3-b]pyridine;2,4-difluoro-6,7-dimethyl-8-(3-methylquinazolin-3-ium-4-yl)-[1]benzofuro[2,3-b]pyridine;2,4-difluoro-7-methyl-8-[3-methyl-7-(3,3,3-trifluoro-2,2-dimethylpropyl)quinazolin-3-ium-4-yl]-[1]benzofuro[2,3-b]pyridine;8-[7-(2,2-dimethylpropyl)-3-methylquinazolin-3-ium-4-yl]-2,4-difluoro-7-methyl-[1]benzofuro[2,3-b]pyridine;2-fluoro-6,7-dimethyl-8-(3-methylquinazolin-3-ium-4-yl)-[1]benzofuro[2,3-b]pyridine
CID 159732573
4,10-Bis(3-methylphenyl)-7,7-diphenyl-3,11-disilatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-[3-(difluoromethyl)phenyl]-5-[4-[[4-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]-bis[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole;2-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-2-pyridinyl)silol-2-yl]-6-pyridin-3-ylpyridine;1,1-dimethyl-2,3,4,5-tetraphenylsilole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 159980368
CID 160192457
CID 160192457
8-[7-(Cyclopentylmethyl)-3-methylquinazolin-3-ium-4-yl]-2,5-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;8-(7-cyclopentyl-3-methylquinazolin-3-ium-4-yl)-2,5-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2,5-difluoro-6,7-dimethyl-8-(3-methyl-7-propan-2-ylquinazolin-3-ium-4-yl)-[1]benzofuro[2,3-b]pyridine;2,5-difluoro-6,7-dimethyl-8-[3-methyl-7-(3,3,3-trifluoro-2,2-dimethylpropyl)quinazolin-3-ium-4-yl]-[1]benzofuro[2,3-b]pyridine
CID 160461772
8-[7-(Cyclopentylmethyl)-3-methylquinazolin-3-ium-4-yl]-2,4-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2,4-difluoro-6,7-dimethyl-8-(3-methyl-7-propan-2-ylquinazolin-3-ium-4-yl)-[1]benzofuro[2,3-b]pyridine;8-[7-(2,2-dimethylpropyl)-3-methylquinazolin-3-ium-4-yl]-2,5-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2-fluoro-6,7-dimethyl-8-[3-methyl-7-(3,3,3-trifluoro-2,2-dimethylpropyl)quinazolin-3-ium-4-yl]-[1]benzofuro[2,3-b]pyridine
CID 161276145
8-(7-Cyclopentyl-3-methylquinazolin-3-ium-4-yl)-2,4-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2,5-difluoro-6,7-dimethyl-8-(3-methyl-7-propan-2-ylquinazolin-3-ium-4-yl)-[1]benzofuro[2,3-b]pyridine;2,4-difluoro-6,7-dimethyl-8-[3-methyl-7-(3,3,3-trifluoro-2,2-dimethylpropyl)quinazolin-3-ium-4-yl]-[1]benzofuro[2,3-b]pyridine;8-[7-(2,2-dimethylpropyl)-3-methylquinazolin-3-ium-4-yl]-2,4-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine
CID 161368778
8-(6-Cyclopentyl-2-methylisoquinolin-2-ium-1-yl)-2,4-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2,4-difluoro-6,7-dimethyl-8-[2-methyl-6-(3,3,3-trifluoro-2,2-dimethylpropyl)isoquinolin-2-ium-1-yl]-[1]benzofuro[2,3-b]pyridine;8-[6-(2,2-dimethylpropyl)-2-methylisoquinolin-2-ium-1-yl]-2,4-difluoro-6,7-dimethyl-[1]benzofuro[2,3-b]pyridine;2-fluoro-7-methyl-8-(3-methylquinazolin-3-ium-4-yl)-[1]benzofuro[2,3-b]pyridine
CID 162214579
6-[3-Fluoro-7-methyl-6-(3-methylpyrimidin-3-ium-4-yl)dibenzofuran-4-yl]-[1]benzofuro[2,3-b]pyridine
CID 164849501
3-[8-[6,9-Bis(5-pyridin-2-ylfuran-2-yl)pyrido[2,3-b]indol-3-yl]dibenzofuran-2-yl]-6,9-bis(5-pyridin-2-ylfuran-2-yl)pyrido[2,3-b]indole
CID 57958229

Frequently Asked Questions

What is the IUPAC name of 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The IUPAC name of 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine (CID 157454663) is 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine.
What is the SMILES notation for 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The canonical SMILES for 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine is CC(C)(C)c1cccc2c1oc1c(-c3cc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cc(-c4cccc5c4oc4c(C(C)(C)C)cccc45)c3)cccc12.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)c(-c4ccc5c(c4)-c4ccccc4[Si]5(C)C)c3)ccc21.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cc3-c3ccc4c(c3)-c3ccccc3[Si]4(C)C)ccc21.C[Si]1(C)c2ccccc2-c2cc(-c3ccc(-c4ccc5c(c4)-c4ccccc4[Si]5(C)C)c(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)c3)ccc21.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc([Si]6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)cc(-c5ccc([Si]6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)c4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc6oc7ncccc7c6c5)cc(-c5ccc6oc7ncccc7c6c5)c4)nc(-c4ccccc4)n3)cc2)cc1.
What is the InChIKey of 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The InChIKey is BTFFIJLIMFCVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H52N2Si2.C60H48N2O2.3C56H44N2Si2.C50H30N4O2/c1-5-21-53(22-6-1)54-37-39-57(40-38-54)70-52-71(78-76(77-70)58-23-7-2-8-24-58)61-50-59(55-41-45-64(46-42-55)79(62-25-9-3-10-26-62)72-33-17-13-29-66(72)67-30-14-18-34-73(67)79)49-60(51-61)56-43-47-65(48-44-56)80(63-27-11-4-12-28-63)74-35-19-15-31-68(74)69-32-16-20-36-75(69)80;1-59(2,3)50-27-15-25-48-46-23-13-21-44(54(46)63-56(48)50)41-33-42(45-22-14-24-47-49-26-16-28-51(60(4,5)6)57(49)64-55(45)47)35-43(34-41)53-36-52(61-58(62-53)40-19-11-8-12-20-40)39-31-29-38(30-32-39)37-17-9-7-10-18-37;1-59(2)52-21-13-11-19-45(52)48-33-41(28-31-54(48)59)44-30-27-43(35-47(44)42-29-32-55-49(34-42)46-20-12-14-22-53(46)60(55,3)4)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-59(2)52-21-13-11-19-45(52)48-34-42(28-31-54(48)59)41-27-30-44(47(33-41)43-29-32-55-49(35-43)46-20-12-14-22-53(46)60(55,3)4)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-59(2)52-21-13-11-19-45(52)48-34-42(28-31-54(48)59)41-27-30-44(43-29-32-55-49(35-43)46-20-12-14-22-53(46)60(55,3)4)47(33-41)51-36-50(57-56(58-51)40-17-9-6-10-18-40)39-25-23-38(24-26-39)37-15-7-5-8-16-37;1-3-9-31(10-4-1)32-15-17-33(18-16-32)44-30-45(54-48(53-44)34-11-5-2-6-12-34)39-26-37(35-19-21-46-42(28-35)40-13-7-23-51-49(40)55-46)25-38(27-39)36-20-22-47-43(29-36)41-14-8-24-52-50(41)56-47/h1-52H;7-36H,1-6H3;3*5-36H,1-4H3;1-30H.
What are the key properties of 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine?
6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine has a molecular weight of 5000.77 g/mol, XLogP of 79.39, 40 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-([1]benzofuro[2,3-b]pyridin-6-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;4-[3,5-bis(6-tert-butyldibenzofuran-4-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[2,5-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,4-bis(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-[3,5-bis[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine is sourced from PubChem (CID 157454663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).