C170H130N6 — CID 159225498
N-(3-carbazol-9-yl-5-phenylnaphthalen-1-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[5-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(2-carbazol-9-yl-4-phenylphenyl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine (PubChem CID 159225498) has the molecular formula C170H130N6 and a molecular weight of 2256.95 g/mol. Its IUPAC name is N-(3-carbazol-9-yl-5-phenylnaphthalen-1-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[5-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(2-carbazol-9-yl-4-phenylphenyl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine.
| Compound Name | N-(3-carbazol-9-yl-5-phenylnaphthalen-1-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[5-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(2-carbazol-9-yl-4-phenylphenyl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine |
|---|---|
| PubChem CID | 159225498 |
| Molecular Formula | C170H130N6 |
| Molecular Weight | 2256.95 g/mol |
| Exact Mass | 2255.04 |
| IUPAC Name | N-(3-carbazol-9-yl-5-phenylnaphthalen-1-yl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-[5-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine;N-(2-carbazol-9-yl-4-phenylphenyl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-3-amine |
| SMILES | CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccccc4)cc3-n3c4ccccc4c4ccccc43)c3cccc4c3-c3ccccc3C4(C)C)ccc21.CC1(C)c2ccccc2-c2cc(N(c3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cccc4c3)c3cccc4c3-c3ccccc3C4(C)C)ccc21.CC1(C)c2ccccc2-c2cc(N(c3cccc4c3-c3ccccc3C4(C)C)c3cc(-n4c5ccccc5c5ccccc54)cc4c(-c5ccccc5)cccc34)ccc21 |
| InChI | InChI=1S/2C58H44N2.C54H42N2/c1-57(2)49-24-9-5-19-44(49)48-36-41(31-33-51(48)57)59(55-29-15-26-52-56(55)47-22-6-10-25-50(47)58(52,3)4)40-30-32-43-38(35-40)17-14-23-42(43)37-16-13-18-39(34-37)60-53-27-11-7-20-45(53)46-21-8-12-28-54(46)60;1-57(2)48-26-12-8-20-41(48)47-34-38(32-33-50(47)57)59(54-31-17-28-51-56(54)45-23-9-13-27-49(45)58(51,3)4)55-36-39(35-46-40(24-16-25-44(46)55)37-18-6-5-7-19-37)60-52-29-14-10-21-42(52)43-22-11-15-30-53(43)60;1-53(2)43-23-12-8-19-38(43)42-34-37(30-31-45(42)53)55(50-28-16-25-46-52(50)41-22-9-13-24-44(41)54(46,3)4)49-32-29-36(35-17-6-5-7-18-35)33-51(49)56-47-26-14-10-20-39(47)40-21-11-15-27-48(40)56/h2*5-36H,1-4H3;5-34H,1-4H3 |
| InChIKey | KSFQXXVBGFLFGK-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 |