C275H192N8S8 — CID 159051141
2-N,7-N-bis(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;7-dibenzothiophen-4-yl-N-[4-[4-(N-(7-dibenzothiophen-4-yl-9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-(4-dibenzothiophen-4-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline;4-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline (PubChem CID 159051141) has the molecular formula C275H192N8S8 and a molecular weight of 3865.15 g/mol. Its IUPAC name is 2-N,7-N-bis(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;7-dibenzothiophen-4-yl-N-[4-[4-(N-(7-dibenzothiophen-4-yl-9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-(4-dibenzothiophen-4-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline;4-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline.
| Compound Name | 2-N,7-N-bis(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;7-dibenzothiophen-4-yl-N-[4-[4-(N-(7-dibenzothiophen-4-yl-9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-(4-dibenzothiophen-4-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline;4-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline |
|---|---|
| PubChem CID | 159051141 |
| Molecular Formula | C275H192N8S8 |
| Molecular Weight | 3865.15 g/mol |
| Exact Mass | 3861.30 |
| IUPAC Name | 2-N,7-N-bis(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;7-dibenzothiophen-4-yl-N-[4-[4-(N-(7-dibenzothiophen-4-yl-9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-(4-dibenzothiophen-4-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline;4-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-(N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline |
| SMILES | CC1(C)c2cc(-c3cccc4c3sc3ccccc34)ccc2-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6c(c5)C(C)(C)c5cc(-c7cccc8c7sc7ccccc78)ccc5-6)cc4)cc3)cc21.CC1(C)c2cc(N(c3ccccc3)c3ccc(-c4cccc5c4sc4ccccc45)cc3)ccc2-c2ccc(N(c3ccccc3)c3ccc(-c4cccc5c4sc4ccccc45)cc3)cc21.Cc1ccc(N(c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5cccc6c5sc5ccccc56)cc4)cc3)cc2)c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)cc2)c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)cc5)cc4)cc3)cc2)cc1 |
| InChI | InChI=1S/C78H56N2S2.C72H48N2S2.C63H44N2S2.C62H44N2S2/c1-77(2)69-45-51(59-23-15-25-67-65-21-11-13-27-73(65)81-75(59)67)33-41-61(69)63-43-39-57(47-71(63)77)79(53-17-7-5-8-18-53)55-35-29-49(30-36-55)50-31-37-56(38-32-50)80(54-19-9-6-10-20-54)58-40-44-64-62-42-34-52(46-70(62)78(3,4)72(64)48-58)60-24-16-26-68-66-22-12-14-28-74(66)82-76(60)68;1-3-13-57(14-4-1)73(59-41-33-51(34-42-59)49-25-29-55(30-26-49)63-19-11-21-67-65-17-7-9-23-69(65)75-71(63)67)61-45-37-53(38-46-61)54-39-47-62(48-40-54)74(58-15-5-2-6-16-58)60-43-35-52(36-44-60)50-27-31-56(32-28-50)64-20-12-22-68-66-18-8-10-24-70(66)76-72(64)68;1-63(2)57-39-47(64(43-15-5-3-6-16-43)45-31-27-41(28-32-45)49-21-13-23-55-53-19-9-11-25-59(53)66-61(49)55)35-37-51(57)52-38-36-48(40-58(52)63)65(44-17-7-4-8-18-44)46-33-29-42(30-34-46)50-22-14-24-56-54-20-10-12-26-60(54)67-62(50)56;1-41-17-29-47(30-18-41)63(51-37-25-45(26-38-51)53-11-7-13-57-55-9-3-5-15-59(55)65-61(53)57)49-33-21-43(22-34-49)44-23-35-50(36-24-44)64(48-31-19-42(2)20-32-48)52-39-27-46(28-40-52)54-12-8-14-58-56-10-4-6-16-60(56)66-62(54)58/h5-48H,1-4H3;1-48H;3-40H,1-2H3;3-40H,1-2H3 |
| InChIKey | JXGYUZFGZONZNX-UHFFFAOYSA-N |
| XLogP | 82.65 |
| TPSA | 25.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 37 |
| Heavy Atoms | 291 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3865.15 |
| LogP ≤ 5 | 82.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |