C404H266N12 — CID 158886069
N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylnaphthalen-1-yl)fluoren-2-amine;N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-naphthalen-1-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine (PubChem CID 158886069) has the molecular formula C404H266N12 and a molecular weight of 5288.66 g/mol. Its IUPAC name is N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylnaphthalen-1-yl)fluoren-2-amine;N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-naphthalen-1-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine.
| Compound Name | N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylnaphthalen-1-yl)fluoren-2-amine;N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-naphthalen-1-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine |
|---|---|
| PubChem CID | 158886069 |
| Molecular Formula | C404H266N12 |
| Molecular Weight | 5288.66 g/mol |
| Exact Mass | 5284.12 |
| IUPAC Name | N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylnaphthalen-1-yl)fluoren-2-amine;N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-naphthalen-1-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine |
| SMILES | c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(N(c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)c6ccc7ccccc7c6)cc5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(N(c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)c6cccc7ccccc67)cc5)cc4)ccc32)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1 |
| InChI | InChI=1S/C75H50N2.C71H48N2.C67H44N2.2C65H42N2.C61H40N2/c1-4-19-54(20-5-1)61-46-48-73(66-30-13-12-28-63(61)66)76(60-44-45-65-64-29-14-16-32-69(64)75(70(65)50-60,57-23-6-2-7-24-57)58-25-8-3-9-26-58)59-42-39-52(40-43-59)51-35-37-53(38-36-51)56-41-47-74-68(49-56)67-31-15-17-33-72(67)77(74)71-34-18-22-55-21-10-11-27-62(55)71;1-4-17-49(18-5-1)51-35-40-58(41-36-51)72(60-44-45-63-62-26-12-14-28-66(62)71(67(63)48-60,56-21-6-2-7-22-56)57-23-8-3-9-24-57)59-42-37-52(38-43-59)50-31-33-53(34-32-50)55-39-46-70-65(47-55)64-27-13-15-29-69(64)73(70)68-30-16-20-54-19-10-11-25-61(54)68;1-3-15-45(16-4-1)47-31-36-52(37-32-47)68(54-40-41-58-57-21-9-13-25-63(57)67(64(58)44-54)61-23-11-7-19-55(61)56-20-8-12-24-62(56)67)53-38-33-48(34-39-53)46-27-29-49(30-28-46)50-35-42-66-60(43-50)59-22-10-14-26-65(59)69(66)51-17-5-2-6-18-51;1-2-17-48(18-3-1)67-63-27-13-9-23-56(63)57-41-47(35-40-64(57)67)45-31-29-43(30-32-45)44-33-36-49(37-34-44)66(62-28-14-16-46-15-4-5-19-51(46)62)50-38-39-55-54-22-8-12-26-60(54)65(61(55)42-50)58-24-10-6-20-52(58)53-21-7-11-25-59(53)65;1-2-16-49(17-3-1)67-63-25-13-9-21-57(63)58-41-48(33-39-64(58)67)46-28-26-44(27-29-46)45-30-34-50(35-31-45)66(51-36-32-43-14-4-5-15-47(43)40-51)52-37-38-56-55-20-8-12-24-61(55)65(62(56)42-52)59-22-10-6-18-53(59)54-19-7-11-23-60(54)65;1-3-15-45(16-4-1)62(48-36-37-52-51-21-9-13-25-57(51)61(58(52)40-48)55-23-11-7-19-49(55)50-20-8-12-24-56(50)61)47-34-31-42(32-35-47)41-27-29-43(30-28-41)44-33-38-60-54(39-44)53-22-10-14-26-59(53)63(60)46-17-5-2-6-18-46/h1-50H;1-48H;1-44H;2*1-42H;1-40H |
| InChIKey | JDQKOQCDBOVSMG-UHFFFAOYSA-N |
| XLogP | 106.39 |
| TPSA | 49.02 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 43 |
| Heavy Atoms | 416 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5288.66 |
| LogP ≤ 5 | 106.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |