C324H203N21O5S — CID 162184033
3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(2-phenylbenzimidazol-1-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzothiophen-4-yl]carbazole;3,9-diphenyl-6-[6-(4-phenylquinazolin-2-yl)dibenzofuran-4-yl]carbazole;3-[6-(2,6-diphenylpyrimidin-4-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole (PubChem CID 162184033) has the molecular formula C324H203N21O5S and a molecular weight of 4502.40 g/mol. Its IUPAC name is 3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(2-phenylbenzimidazol-1-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzothiophen-4-yl]carbazole;3,9-diphenyl-6-[6-(4-phenylquinazolin-2-yl)dibenzofuran-4-yl]carbazole;3-[6-(2,6-diphenylpyrimidin-4-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole.
| Compound Name | 3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(2-phenylbenzimidazol-1-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzothiophen-4-yl]carbazole;3,9-diphenyl-6-[6-(4-phenylquinazolin-2-yl)dibenzofuran-4-yl]carbazole;3-[6-(2,6-diphenylpyrimidin-4-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole |
|---|---|
| PubChem CID | 162184033 |
| Molecular Formula | C324H203N21O5S |
| Molecular Weight | 4502.40 g/mol |
| Exact Mass | 4498.60 |
| IUPAC Name | 3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(2-phenylbenzimidazol-1-yl)dibenzofuran-4-yl]carbazole;3,9-diphenyl-6-[6-(1-phenylbenzimidazol-2-yl)dibenzothiophen-4-yl]carbazole;3,9-diphenyl-6-[6-(4-phenylquinazolin-2-yl)dibenzofuran-4-yl]carbazole;3-[6-(2,6-diphenylpyrimidin-4-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole |
| SMILES | c1ccc(-c2cc(-c3cccc4c3oc3c(-c5ccc6c(c5)c5cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc5n6-c5ccccc5)cccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4cccc5c4oc4c(-c6nc(-c7ccccc7)c7ccccc7n6)cccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4cccc5c4oc4c(-c6nc7ccccc7n6-c6ccccc6)cccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4cccc5c4oc4c(-n6c(-c7ccccc7)nc7ccccc76)cccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4cccc5c4sc4c(-c6nc7ccccc7n6-c6ccccc6)cccc45)ccc2n3-c2ccccc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3oc3c(-c5ccc6c(c5)c5cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc5n6-c5ccccc5)cccc34)n2)cc1 |
| InChI | InChI=1S/C64H40N4O.C63H39N5O.C50H31N3O.2C49H31N3O.C49H31N3S/c1-5-17-41(18-6-1)56-40-57(66-64(65-56)42-19-7-2-8-20-42)52-29-16-28-51-50-27-15-26-48(62(50)69-63(51)52)45-33-36-61-55(39-45)54-38-44(32-35-60(54)68(61)47-23-11-4-12-24-47)43-31-34-59-53(37-43)49-25-13-14-30-58(49)67(59)46-21-9-3-10-22-46;1-5-17-40(18-6-1)61-64-62(41-19-7-2-8-20-41)66-63(65-61)51-29-16-28-50-49-27-15-26-47(59(49)69-60(50)51)44-33-36-58-54(39-44)53-38-43(32-35-57(53)68(58)46-23-11-4-12-24-46)42-31-34-56-52(37-42)48-25-13-14-30-55(48)67(56)45-21-9-3-10-22-45;1-4-14-32(15-5-1)34-26-28-45-42(30-34)43-31-35(27-29-46(43)53(45)36-18-8-3-9-19-36)37-21-12-22-38-39-23-13-24-41(49(39)54-48(37)38)50-51-44-25-11-10-20-40(44)47(52-50)33-16-6-2-7-17-33;1-4-14-32(15-5-1)33-26-28-44-41(30-33)42-31-34(27-29-45(42)51(44)35-16-6-2-7-17-35)37-20-12-21-38-39-22-13-23-40(48(39)53-47(37)38)49-50-43-24-10-11-25-46(43)52(49)36-18-8-3-9-19-36;1-4-14-32(15-5-1)34-26-28-43-40(30-34)41-31-35(27-29-44(41)51(43)36-18-8-3-9-19-36)37-20-12-21-38-39-22-13-25-46(48(39)53-47(37)38)52-45-24-11-10-23-42(45)50-49(52)33-16-6-2-7-17-33;1-4-14-32(15-5-1)33-26-28-44-41(30-33)42-31-34(27-29-45(42)51(44)35-16-6-2-7-17-35)37-20-12-21-38-39-22-13-23-40(48(39)53-47(37)38)49-50-43-24-10-11-25-46(43)52(49)36-18-8-3-9-19-36/h1-40H;1-39H;1-31H;3*1-31H |
| InChIKey | ZPKPGHMVSKWZAG-UHFFFAOYSA-N |
| XLogP | 86.04 |
| TPSA | 248.83 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 27 |
| Rotatable Bonds | 34 |
| Heavy Atoms | 351 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4502.40 |
| LogP ≤ 5 | 86.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 27 |