C138H88N8 — CID 157284069
1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)carbazole;1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazole (PubChem CID 157284069) has the molecular formula C138H88N8 and a molecular weight of 1858.28 g/mol. Its IUPAC name is 1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)carbazole;1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazole.
| Compound Name | 1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)carbazole;1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazole |
|---|---|
| PubChem CID | 157284069 |
| Molecular Formula | C138H88N8 |
| Molecular Weight | 1858.28 g/mol |
| Exact Mass | 1856.71 |
| IUPAC Name | 1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)carbazole;1-carbazol-9-yl-3-(4-carbazol-9-ylphenyl)-9-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazole |
| SMILES | c1ccc(-c2ccc3c(c2)c2cc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc(-n6c7ccccc7c7ccccc76)c54)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc(-n6c7ccccc7c7ccccc76)c54)ccc2n3-c2ccccc2)cc1 |
| InChI | InChI=1S/C72H46N4.C66H42N4/c1-4-18-47(19-5-1)50-34-39-68-60(42-50)62-46-55(38-41-69(62)73(68)53-22-8-3-9-23-53)75-70-40-35-51(48-20-6-2-7-21-48)43-61(70)63-44-52(45-71(72(63)75)76-66-30-16-12-26-58(66)59-27-13-17-31-67(59)76)49-32-36-54(37-33-49)74-64-28-14-10-24-56(64)57-25-11-15-29-65(57)74;1-3-17-43(18-4-1)45-33-37-63-55(39-45)56-42-49(36-38-64(56)67(63)47-19-5-2-6-20-47)69-60-28-14-11-25-54(60)57-40-46(41-65(66(57)69)70-61-29-15-9-23-52(61)53-24-10-16-30-62(53)70)44-31-34-48(35-32-44)68-58-26-12-7-21-50(58)51-22-8-13-27-59(51)68/h1-46H;1-42H |
| InChIKey | BAACHACKQKJEHT-UHFFFAOYSA-N |
| XLogP | 36.49 |
| TPSA | 39.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 146 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1858.28 |
| LogP ≤ 5 | 36.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |