C203H139N7 — CID 158025945
N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-N-(4-pyridin-3-ylphenyl)-4-[3-[9-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-yl]phenyl]aniline (PubChem CID 158025945) has the molecular formula C203H139N7 and a molecular weight of 2676.39 g/mol. Its IUPAC name is N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-N-(4-pyridin-3-ylphenyl)-4-[3-[9-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-yl]phenyl]aniline.
| Compound Name | N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-N-(4-pyridin-3-ylphenyl)-4-[3-[9-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-yl]phenyl]aniline |
|---|---|
| PubChem CID | 158025945 |
| Molecular Formula | C203H139N7 |
| Molecular Weight | 2676.39 g/mol |
| Exact Mass | 2674.11 |
| IUPAC Name | N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-N-(4-pyridin-3-ylphenyl)-4-[3-[9-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-yl]phenyl]aniline |
| SMILES | CC1(C)c2ccccc2-c2cc(N(c3ccccc3)c3ccc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)c4)cc3)ccc21.c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)c4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3cccnc3)cc2)c2ccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c3)cc2)cc1 |
| InChI | InChI=1S/C70H50N2.C67H46N2.C66H43N3/c1-69(2)63-30-15-12-27-57(63)60-45-55(38-40-64(60)69)71(53-25-10-5-11-26-53)54-36-33-47(34-37-54)48-19-18-20-49(43-48)50-35-42-68-62(44-50)59-29-14-17-32-67(59)72(68)56-39-41-66-61(46-56)58-28-13-16-31-65(58)70(66,51-21-6-3-7-22-51)52-23-8-4-9-24-52;1-5-18-47(19-6-1)48-32-37-56(38-33-48)68(55-26-11-4-12-27-55)57-39-34-49(35-40-57)50-20-17-21-51(44-50)52-36-43-66-62(45-52)60-29-14-16-31-65(60)69(66)58-41-42-64-61(46-58)59-28-13-15-30-63(59)67(64,53-22-7-2-8-23-53)54-24-9-3-10-25-54;1-2-17-50(18-3-1)68(52-34-29-45(30-35-52)49-16-13-39-67-43-49)51-32-27-44(28-33-51)46-14-12-15-47(40-46)48-31-38-65-59(41-48)58-22-7-11-26-64(58)69(65)53-36-37-57-56-21-6-10-25-62(56)66(63(57)42-53)60-23-8-4-19-54(60)55-20-5-9-24-61(55)66/h3-46H,1-2H3;1-46H;1-43H |
| InChIKey | FGPKWOWMCCPAFI-UHFFFAOYSA-N |
| XLogP | 52.87 |
| TPSA | 37.40 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 210 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2676.39 |
| LogP ≤ 5 | 52.87 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |