C206H145N3O — CID 161068625
N-[4-(7-dibenzofuran-4-yl-9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine (PubChem CID 161068625) has the molecular formula C206H145N3O and a molecular weight of 2678.45 g/mol. Its IUPAC name is N-[4-(7-dibenzofuran-4-yl-9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine.
| Compound Name | N-[4-(7-dibenzofuran-4-yl-9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine |
|---|---|
| PubChem CID | 161068625 |
| Molecular Formula | C206H145N3O |
| Molecular Weight | 2678.45 g/mol |
| Exact Mass | 2676.14 |
| IUPAC Name | N-[4-(7-dibenzofuran-4-yl-9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4cccc5c4-c4ccc(-c6cccc7c6oc6ccccc67)cc4C5(c4ccccc4)c4ccccc4)cc3)cc21 |
| InChI | InChI=1S/C71H49N.C71H51N.C64H45NO/c1-69(2)60-30-14-9-24-53(60)57-42-40-50(44-66(57)69)72(51-41-43-58-56-27-12-17-33-63(56)71(67(58)45-51)61-31-15-10-25-54(61)55-26-11-16-32-62(55)71)49-38-36-46(37-39-49)52-29-19-35-65-68(52)59-28-13-18-34-64(59)70(65,47-20-5-3-6-21-47)48-22-7-4-8-23-48;1-69(2)62-34-18-15-30-57(62)59-44-42-54(46-66(59)69)72(55-43-45-60-58-31-16-19-35-63(58)71(67(60)47-55,51-26-11-5-12-27-51)52-28-13-6-14-29-52)53-40-38-48(39-41-53)56-33-21-37-65-68(56)61-32-17-20-36-64(61)70(65,49-22-7-3-8-23-49)50-24-9-4-10-25-50;1-63(2)56-29-14-12-24-51(56)52-39-37-48(41-58(52)63)65(46-22-10-5-11-23-46)47-35-32-42(33-36-47)49-26-17-30-57-61(49)55-38-34-43(50-27-16-28-54-53-25-13-15-31-60(53)66-62(50)54)40-59(55)64(57,44-18-6-3-7-19-44)45-20-8-4-9-21-45/h3-45H,1-2H3;3-47H,1-2H3;3-41H,1-2H3 |
| InChIKey | UEJBXQCOIQLIAT-UHFFFAOYSA-N |
| XLogP | 52.75 |
| TPSA | 22.86 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 21 |
| Heavy Atoms | 210 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2678.45 |
| LogP ≤ 5 | 52.75 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |