C170H130N6 — CID 158279061
N-[4-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(7-carbazol-9-yl-4-phenylnaphthalen-2-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine (PubChem CID 158279061) has the molecular formula C170H130N6 and a molecular weight of 2256.95 g/mol. Its IUPAC name is N-[4-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(7-carbazol-9-yl-4-phenylnaphthalen-2-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine.
| Compound Name | N-[4-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(7-carbazol-9-yl-4-phenylnaphthalen-2-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine |
|---|---|
| PubChem CID | 158279061 |
| Molecular Formula | C170H130N6 |
| Molecular Weight | 2256.95 g/mol |
| Exact Mass | 2255.04 |
| IUPAC Name | N-[4-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(7-carbazol-9-yl-4-phenylnaphthalen-2-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine |
| SMILES | CC1(C)c2ccccc2-c2cc(N(c3cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c4ccccc4c3)c3cccc4c3-c3ccccc3C4(C)C)ccc21.CC1(C)c2ccccc2-c2cc(N(c3cc(-c4ccccc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4c3)c3cccc4c3-c3ccccc3C4(C)C)ccc21.CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)c3cccc4c3-c3ccccc3C4(C)C)ccc21 |
| InChI | InChI=1S/2C58H44N2.C54H42N2/c1-57(2)49-25-11-7-21-43(49)48-35-40(31-32-51(48)57)59(55-30-16-27-52-56(55)46-24-8-12-26-50(46)58(52,3)4)41-34-37-17-5-6-20-42(37)47(36-41)38-18-15-19-39(33-38)60-53-28-13-9-22-44(53)45-23-10-14-29-54(45)60;1-57(2)49-23-12-8-19-43(49)48-35-40(30-32-51(48)57)59(55-28-16-25-52-56(55)46-22-9-13-24-50(46)58(52,3)4)41-34-38-33-39(29-31-42(38)47(36-41)37-17-6-5-7-18-37)60-53-26-14-10-20-44(53)45-21-11-15-27-54(45)60;1-53(2)45-21-9-5-17-40(45)44-34-39(31-32-47(44)53)55(51-26-14-23-48-52(51)43-20-6-10-22-46(43)54(48,3)4)37-29-27-35(28-30-37)36-15-13-16-38(33-36)56-49-24-11-7-18-41(49)42-19-8-12-25-50(42)56/h2*5-36H,1-4H3;5-34H,1-4H3 |
| InChIKey | GJZFACWJVYWELS-UHFFFAOYSA-N |
| XLogP | 45.91 |
| TPSA | 24.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 176 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2256.95 |
| LogP ≤ 5 | 45.91 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |