C214H143N7O2 — CID 157312181
N-[4-(9H-carbazol-1-yl)phenyl]-9,9-dimethyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]fluoren-4-amine;N-(4-dibenzofuran-4-ylphenyl)-4-phenyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine (PubChem CID 157312181) has the molecular formula C214H143N7O2 and a molecular weight of 2844.54 g/mol. Its IUPAC name is N-[4-(9H-carbazol-1-yl)phenyl]-9,9-dimethyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]fluoren-4-amine;N-(4-dibenzofuran-4-ylphenyl)-4-phenyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine.
| Compound Name | N-[4-(9H-carbazol-1-yl)phenyl]-9,9-dimethyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]fluoren-4-amine;N-(4-dibenzofuran-4-ylphenyl)-4-phenyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine |
|---|---|
| PubChem CID | 157312181 |
| Molecular Formula | C214H143N7O2 |
| Molecular Weight | 2844.54 g/mol |
| Exact Mass | 2842.13 |
| IUPAC Name | N-[4-(9H-carbazol-1-yl)phenyl]-9,9-dimethyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]fluoren-4-amine;N-(4-dibenzofuran-4-ylphenyl)-4-phenyl-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine |
| SMILES | CC1(C)c2ccccc2-c2c(N(c3ccc(-c4ccc5c(c4)c4cc(-c6ccccc6)cc(-c6ccccc6)c4n5-c4ccccc4)cc3)c3ccc(-c4cccc5c4[nH]c4ccccc45)cc3)cccc21.c1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5cccc6c5-c5ccccc5C65c6ccccc6-c6ccccc65)cc4)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4cc(-c6ccccc6)cc(-c6ccccc6)c4n5-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1 |
| InChI | InChI=1S/C79H50N2O.C69H49N3.C66H44N2O/c1-4-20-51(21-5-1)56-49-66(53-22-6-2-7-23-53)77-68(50-56)67-48-55(42-47-73(67)81(77)57-24-8-3-9-25-57)52-38-43-58(44-39-52)80(59-45-40-54(41-46-59)60-30-18-31-64-63-28-13-17-37-75(63)82-78(60)64)74-36-19-35-72-76(74)65-29-12-16-34-71(65)79(72)69-32-14-10-26-61(69)62-27-11-15-33-70(62)79;1-69(2)61-28-14-12-25-57(61)66-62(69)29-17-31-65(66)71(53-39-34-48(35-40-53)54-26-16-27-56-55-24-13-15-30-63(55)70-67(54)56)52-37-32-46(33-38-52)49-36-41-64-59(42-49)60-44-50(45-18-6-3-7-19-45)43-58(47-20-8-4-9-21-47)68(60)72(64)51-22-10-5-11-23-51;1-5-16-45(17-6-1)47-28-35-54(36-29-47)67(56-39-32-50(33-40-56)57-25-15-26-59-58-24-13-14-27-64(58)69-66(57)59)55-37-30-48(31-38-55)51-34-41-63-61(42-51)62-44-52(46-18-7-2-8-19-46)43-60(49-20-9-3-10-21-49)65(62)68(63)53-22-11-4-12-23-53/h1-50H;3-44,70H,1-2H3;1-44H |
| InChIKey | BDDXUHYRPAMFCN-UHFFFAOYSA-N |
| XLogP | 58.51 |
| TPSA | 66.58 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 223 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2844.54 |
| LogP ≤ 5 | 58.51 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 8 |