C414H284N12 — CID 161329368
2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(3-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(4-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline;N-[2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline (PubChem CID 161329368) has the molecular formula C414H284N12 and a molecular weight of 5426.91 g/mol. Its IUPAC name is 2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(3-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(4-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline;N-[2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline.
| Compound Name | 2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(3-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(4-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline;N-[2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline |
|---|---|
| PubChem CID | 161329368 |
| Molecular Formula | C414H284N12 |
| Molecular Weight | 5426.91 g/mol |
| Exact Mass | 5422.26 |
| IUPAC Name | 2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(3-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(4-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline;N-[2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline |
| SMILES | c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3-c3ccc(-c4ccc5c6ccccc6n(-c6ccc7c(c6)-c6ccccc6C7(c6ccccc6)c6ccccc6)c5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3-c3ccc(-c4ccc5c6ccccc6n(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5c4)cc3)cc2-c2ccccc2)cc1.c1ccc(-c2cccc(-c3ccc(N(c4ccccc4)c4ccccc4-c4ccc(-c5ccc6c7ccccc7n(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccccc7-8)c6c5)cc4)cc3)c2)cc1.c1ccc(-c2cccc(N(c3ccccc3)c3ccccc3-c3ccc(-c4ccc5c6ccccc6n(-c6ccc7c(c6)-c6ccccc6C7(c6ccccc6)c6ccccc6)c5c4)cc3)c2)cc1.c1ccc(-c2ccccc2-c2ccc(N(c3ccccc3)c3ccccc3-c3ccc(-c4ccc5c6ccccc6n(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5c4)cc3)cc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2-c2ccc(-c3ccc4c5ccccc5n(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)c4c3)cc2)cc1 |
| InChI | InChI=1S/3C73H50N2.2C67H46N2.C61H42N2/c1-6-22-52(23-7-1)61-46-43-59(49-67(61)53-24-8-2-9-25-53)74(58-30-14-5-15-31-58)70-36-20-17-32-62(70)54-40-38-51(39-41-54)55-42-45-66-65-34-18-21-37-71(65)75(72(66)48-55)60-44-47-64-63-33-16-19-35-68(63)73(69(64)50-60,56-26-10-3-11-27-56)57-28-12-4-13-29-57;1-5-20-51(21-6-1)55-22-19-23-56(48-55)53-40-43-61(44-41-53)74(60-28-11-4-12-29-60)70-34-17-14-30-63(70)54-38-36-52(37-39-54)57-42-46-67-66-32-15-18-35-71(66)75(72(67)49-57)62-45-47-65-64-31-13-16-33-68(64)73(69(65)50-62,58-24-7-2-8-25-58)59-26-9-3-10-27-59;1-5-21-52(22-6-1)61-29-13-14-30-62(61)53-41-44-59(45-42-53)74(58-27-11-4-12-28-58)70-35-19-16-31-63(70)54-39-37-51(38-40-54)55-43-47-67-66-33-17-20-36-71(66)75(72(67)49-55)60-46-48-65-64-32-15-18-34-68(64)73(69(65)50-60,56-23-7-2-8-24-56)57-25-9-3-10-26-57;1-5-20-47(21-6-1)50-22-19-29-55(44-50)68(54-27-11-4-12-28-54)64-34-17-14-30-57(64)49-38-36-48(37-39-49)51-40-42-60-59-32-15-18-35-65(59)69(66(60)45-51)56-41-43-63-61(46-56)58-31-13-16-33-62(58)67(63,52-23-7-2-8-24-52)53-25-9-3-10-26-53;1-5-19-47(20-6-1)48-37-40-55(41-38-48)68(54-25-11-4-12-26-54)64-31-17-14-27-57(64)50-35-33-49(34-36-50)51-39-43-60-59-29-15-18-32-65(59)69(66(60)45-51)56-42-44-63-61(46-56)58-28-13-16-30-62(58)67(63,52-21-7-2-8-22-52)53-23-9-3-10-24-53;1-5-19-46(20-6-1)61(47-21-7-2-8-22-47)56-30-16-13-28-52(56)55-42-50(38-40-57(55)61)63-59-32-18-15-29-53(59)54-39-37-45(41-60(54)63)43-33-35-44(36-34-43)51-27-14-17-31-58(51)62(48-23-9-3-10-24-48)49-25-11-4-12-26-49/h3*1-50H;2*1-46H;1-42H |
| InChIKey | VLFFGOCSFHFFDG-UHFFFAOYSA-N |
| XLogP | 109.04 |
| TPSA | 49.02 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 56 |
| Heavy Atoms | 426 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5426.91 |
| LogP ≤ 5 | 109.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |