About 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole
2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole (PubChem CID 160736449) has the molecular formula C309H200N24O2S8Si2
and a molecular weight of 4593.87 g/mol. Its IUPAC name is 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole.
Frequently Asked Questions
What is the IUPAC name of 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole?
The IUPAC name of 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole (CID 160736449) is 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole.
What is the SMILES notation for 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole?
The canonical SMILES for 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole is C1=C(c2ccc3c(c2)-c2cc(-n4c(-c5nccs5)ccc4-c4nccs4)ccc2[Si]3(c2ccccc2)c2ccccc2)SC2C=C(c3ccc4c(c3)-c3cc(-n5c(-c6nccs6)ccc5-c5nccs5)ccc3[Si]4(c3ccccc3)c3ccccc3)SC12.c1ccc(-c2ccc3oc4ccc(-c5ccc6c(c5)c5cc(-c7ccccc7-c7ccccn7)ccc5n6-c5ccc6sc7ccccc7c6c5)cc4c3c2)nc1.c1ccc(-c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(C4(c5ccc(-n6c7ccccc7c7cc(-c8cccc(-c9ccccc9)n8)ccc76)cc5)CCCCC4)cc3)n2)cc1.c1ccc(-c2cncc(-c3ccc4c(n3)c3nc(-c5cncc(-c6ccccc6)c5)ccc3n4-c3ccc4c(c3)c3cnccc3n4-c3ccc4oc5ccccc5c4c3)c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5sc6ccc(-n7c8ccc(-c9ccccc9-c9ccccn9)cc8c8cc(-c9ccccc9-c9ccccn9)ccc87)cc6c5c4)ccc32)cc1.
What is the InChIKey of 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole?
The InChIKey is RUZZFQBISNVQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N6S6Si2.C64H40N4S.C64H48N4.C55H33N7O.C52H31N3OS/c1-5-13-51(14-6-1)87(52-15-7-2-8-16-52)67-29-21-47(41-55(67)57-43-49(23-31-69(57)87)79-59(71-75-33-37-81-71)25-26-60(79)72-76-34-38-82-72)63-45-65-66(85-63)46-64(86-65)48-22-30-68-56(42-48)58-44-50(80-61(73-77-35-39-83-73)27-28-62(80)74-78-36-40-84-74)24-32-70(58)88(68,53-17-9-3-10-18-53)54-19-11-4-12-20-54;1-2-14-45(15-3-1)67-59-23-9-8-20-51(59)52-36-41(24-29-60(52)67)42-27-32-63-55(37-42)56-40-46(28-33-64(56)69-63)68-61-30-25-43(47-16-4-6-18-49(47)57-21-10-12-34-65-57)38-53(61)54-39-44(26-31-62(54)68)48-17-5-7-19-50(48)58-22-11-13-35-66-58;1-4-16-44(17-5-1)56-22-14-24-58(65-56)46-28-38-62-54(42-46)52-20-8-10-26-60(52)67(62)50-34-30-48(31-35-50)64(40-12-3-13-41-64)49-32-36-51(37-33-49)68-61-27-11-9-21-53(61)55-43-47(29-39-63(55)68)59-25-15-23-57(66-59)45-18-6-2-7-19-45;1-3-9-34(10-4-1)36-25-38(31-57-29-36)46-17-20-50-54(59-46)55-51(21-18-47(60-55)39-26-37(30-58-32-39)35-11-5-2-6-12-35)62(50)40-15-19-48-43(27-40)45-33-56-24-23-49(45)61(48)41-16-22-53-44(28-41)42-13-7-8-14-52(42)63-53;1-2-10-38(46-13-6-8-26-54-46)37(9-1)34-16-21-48-41(29-34)40-27-32(15-20-47(40)55(48)36-19-24-52-44(31-36)39-11-3-4-14-51(39)57-52)33-17-22-49-42(28-33)43-30-35(18-23-50(43)56-49)45-12-5-7-25-53-45/h1-46,65-66H;1-40H;1-2,4-11,14-39,42-43H,3,12-13,40-41H2;1-33H;1-31H.
What are the key properties of 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole?
2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole has a molecular weight of 4593.87 g/mol, XLogP of 75.99, 38 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[8-[5-[2-[2,5-bis(1,3-thiazol-2-yl)pyrrol-1-yl]-5,5-diphenylbenzo[b][1]benzosilol-8-yl]-3a,6a-dihydrothieno[3,2-b]thiophen-2-yl]-5,5-diphenylbenzo[b][1]benzosilol-2-yl]-5-(1,3-thiazol-2-yl)pyrrol-2-yl]-1,3-thiazole;8-(5-dibenzofuran-2-ylpyrido[4,3-b]indol-8-yl)-4,12-bis(5-phenyl-3-pyridinyl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;9-dibenzothiophen-2-yl-3-(8-pyridin-2-yldibenzofuran-2-yl)-6-(2-pyridin-2-ylphenyl)carbazole;9-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole;3-(6-phenyl-2-pyridinyl)-9-[4-[1-[4-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]phenyl]cyclohexyl]phenyl]carbazole is sourced from PubChem (CID 160736449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).