C135H88N10OSi — CID 163832748
9-[2-(2-carbazol-9-yldibenzofuran-4-yl)phenyl]carbazole;[9-[2-(2-carbazol-9-ylphenyl)phenyl]carbazol-2-yl]-triphenylsilane;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 163832748) has the molecular formula C135H88N10OSi and a molecular weight of 1894.34 g/mol. Its IUPAC name is 9-[2-(2-carbazol-9-yldibenzofuran-4-yl)phenyl]carbazole;[9-[2-(2-carbazol-9-ylphenyl)phenyl]carbazol-2-yl]-triphenylsilane;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]carbazole.
| Compound Name | 9-[2-(2-carbazol-9-yldibenzofuran-4-yl)phenyl]carbazole;[9-[2-(2-carbazol-9-ylphenyl)phenyl]carbazol-2-yl]-triphenylsilane;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]carbazole |
|---|---|
| PubChem CID | 163832748 |
| Molecular Formula | C135H88N10OSi |
| Molecular Weight | 1894.34 g/mol |
| Exact Mass | 1892.69 |
| IUPAC Name | 9-[2-(2-carbazol-9-yldibenzofuran-4-yl)phenyl]carbazole;[9-[2-(2-carbazol-9-ylphenyl)phenyl]carbazol-2-yl]-triphenylsilane;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]carbazole |
| SMILES | c1ccc(-n2c3ccccc3c3ccccc32)c(-c2cc(-n3c4ccccc4c4ccccc43)cc3c2oc2ccccc23)c1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3c4ccccc4n(-c4ccccc4-c4ccccc4-n4c5ccccc5c5ccccc54)c3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)n1 |
| InChI | InChI=1S/C54H38N2Si.C42H26N2O.C39H24N6/c1-4-20-39(21-5-1)57(40-22-6-2-7-23-40,41-24-8-3-9-25-41)42-36-37-48-47-30-14-19-35-53(47)56(54(48)38-42)52-34-18-13-29-46(52)45-28-12-17-33-51(45)55-49-31-15-10-26-43(49)44-27-11-16-32-50(44)55;1-7-19-36-28(13-1)29-14-2-8-20-37(29)43(36)27-25-34(42-35(26-27)33-18-6-12-24-41(33)45-42)32-17-5-11-23-40(32)44-38-21-9-3-15-30(38)31-16-4-10-22-39(31)44;1-7-19-31-25(13-1)26-14-2-8-20-32(26)43(31)37-40-38(44-33-21-9-3-15-27(33)28-16-4-10-22-34(28)44)42-39(41-37)45-35-23-11-5-17-29(35)30-18-6-12-24-36(30)45/h1-38H;1-26H;1-24H |
| InChIKey | OFBVFTALXPAZSD-UHFFFAOYSA-N |
| XLogP | 31.54 |
| TPSA | 86.32 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 147 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1894.34 |
| LogP ≤ 5 | 31.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
|---|