C234H156N8O4S4 — CID 162064792
3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6,9-diphenylcarbazole;3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6-phenyl-9-(3-phenylphenyl)carbazole;3-[9-(3-dibenzothiophen-2-ylphenyl)-6-phenylcarbazol-3-yl]oxy-6,9-diphenylcarbazole;3-[9-dibenzothiophen-2-yl-6-(2,4,6-trimethylphenyl)carbazol-3-yl]oxy-9-phenyl-6-(2,4,6-trimethylphenyl)carbazole (PubChem CID 162064792) has the molecular formula C234H156N8O4S4 and a molecular weight of 3272.14 g/mol. Its IUPAC name is 3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6,9-diphenylcarbazole;3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6-phenyl-9-(3-phenylphenyl)carbazole;3-[9-(3-dibenzothiophen-2-ylphenyl)-6-phenylcarbazol-3-yl]oxy-6,9-diphenylcarbazole;3-[9-dibenzothiophen-2-yl-6-(2,4,6-trimethylphenyl)carbazol-3-yl]oxy-9-phenyl-6-(2,4,6-trimethylphenyl)carbazole.
| Compound Name | 3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6,9-diphenylcarbazole;3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6-phenyl-9-(3-phenylphenyl)carbazole;3-[9-(3-dibenzothiophen-2-ylphenyl)-6-phenylcarbazol-3-yl]oxy-6,9-diphenylcarbazole;3-[9-dibenzothiophen-2-yl-6-(2,4,6-trimethylphenyl)carbazol-3-yl]oxy-9-phenyl-6-(2,4,6-trimethylphenyl)carbazole |
|---|---|
| PubChem CID | 162064792 |
| Molecular Formula | C234H156N8O4S4 |
| Molecular Weight | 3272.14 g/mol |
| Exact Mass | 3269.11 |
| IUPAC Name | 3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6,9-diphenylcarbazole;3-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)oxy-6-phenyl-9-(3-phenylphenyl)carbazole;3-[9-(3-dibenzothiophen-2-ylphenyl)-6-phenylcarbazol-3-yl]oxy-6,9-diphenylcarbazole;3-[9-dibenzothiophen-2-yl-6-(2,4,6-trimethylphenyl)carbazol-3-yl]oxy-9-phenyl-6-(2,4,6-trimethylphenyl)carbazole |
| SMILES | Cc1cc(C)c(-c2ccc3c(c2)c2cc(Oc4ccc5c(c4)c4cc(-c6c(C)cc(C)cc6C)ccc4n5-c4ccc5sc6ccccc6c5c4)ccc2n3-c2ccccc2)c(C)c1.c1ccc(-c2ccc3c(c2)c2cc(Oc4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4ccc5sc6ccccc6c5c4)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(Oc4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4cccc(-c5ccc6sc7ccccc7c6c5)c4)ccc2n3-c2ccccc2)cc1.c1ccc(-c2cccc(-n3c4ccc(Oc5ccc6c(c5)c5cc(-c7ccccc7)ccc5n6-c5ccc6sc7ccccc7c6c5)cc4c4cc(-c5ccccc5)ccc43)c2)cc1 |
| InChI | InChI=1S/2C60H38N2OS.C60H46N2OS.C54H34N2OS/c1-4-13-39(14-5-1)42-23-28-55-50(34-42)52-37-47(26-30-57(52)61(55)45-18-8-3-9-19-45)63-48-27-31-58-53(38-48)51-35-43(40-15-6-2-7-16-40)24-29-56(51)62(58)46-20-12-17-41(33-46)44-25-32-60-54(36-44)49-21-10-11-22-59(49)64-60;1-4-13-39(14-5-1)42-19-12-20-45(33-42)61-55-28-23-43(40-15-6-2-7-16-40)34-50(55)52-37-47(26-30-57(52)61)63-48-27-31-58-53(38-48)51-35-44(41-17-8-3-9-18-41)24-29-56(51)62(58)46-25-32-60-54(36-46)49-21-10-11-22-59(49)64-60;1-35-26-37(3)59(38(4)27-35)41-16-21-53-48(30-41)50-33-45(19-23-55(50)61(53)43-12-8-7-9-13-43)63-46-20-24-56-51(34-46)49-31-42(60-39(5)28-36(2)29-40(60)6)17-22-54(49)62(56)44-18-25-58-52(32-44)47-14-10-11-15-57(47)64-58;1-4-12-35(13-5-1)37-20-25-49-44(30-37)46-33-41(23-27-51(46)55(49)39-16-8-3-9-17-39)57-42-24-28-52-47(34-42)45-31-38(36-14-6-2-7-15-36)21-26-50(45)56(52)40-22-29-54-48(32-40)43-18-10-11-19-53(43)58-54/h2*1-38H;7-34H,1-6H3;1-34H |
| InChIKey | ZAHXJVSFGBVHCR-UHFFFAOYSA-N |
| XLogP | 66.68 |
| TPSA | 76.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 250 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3272.14 |
| LogP ≤ 5 | 66.68 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |