C296H182N4O7 — CID 157355405
3,6-bis(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;3-(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[3-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole (PubChem CID 157355405) has the molecular formula C296H182N4O7 and a molecular weight of 3906.73 g/mol. Its IUPAC name is 3,6-bis(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;3-(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[3-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole.
| Compound Name | 3,6-bis(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;3-(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[3-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole |
|---|---|
| PubChem CID | 157355405 |
| Molecular Formula | C296H182N4O7 |
| Molecular Weight | 3906.73 g/mol |
| Exact Mass | 3903.40 |
| IUPAC Name | 3,6-bis(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;3-(2,8-diphenyldibenzofuran-4-yl)-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[3-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(6-phenyldibenzofuran-4-yl)carbazole |
| SMILES | c1ccc(-c2c3ccccc3c(-c3ccc(-n4c5ccc(-c6cccc7c6oc6c(-c8ccccc8)cccc67)cc5c5cc(-c6cccc7c6oc6c(-c8ccccc8)cccc67)ccc54)cc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-n4c5ccc(-c6cccc7c6oc6c(-c8ccccc8)cccc67)cc5c5cc(-c6cccc7c6oc6c(-c8ccccc8)cccc67)ccc54)c3)c3ccccc23)cc1.c1ccc(-c2ccc3oc4c(-c5ccc6c(c5)c5cc(-c7cc(-c8ccccc8)cc8c7oc7ccc(-c9ccccc9)cc78)ccc5n6-c5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2ccc3oc4c(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)cc(-c5ccccc5)cc4c3c2)cc1 |
| InChI | InChI=1S/C86H53NO2.2C74H45NO2.C62H39NO/c1-6-20-54(21-7-1)60-38-44-81-75(46-60)77-52-64(56-24-10-3-11-25-56)50-71(85(77)88-81)62-36-42-79-73(48-62)74-49-63(72-51-65(57-26-12-4-13-27-57)53-78-76-47-61(55-22-8-2-9-23-55)39-45-82(76)89-86(72)78)37-43-80(74)87(79)66-40-34-59(35-41-66)84-69-32-18-16-30-67(69)83(58-28-14-5-15-29-58)68-31-17-19-33-70(68)84;1-4-19-46(20-5-1)53-31-15-35-61-63-37-17-33-55(73(63)76-71(53)61)49-39-41-67-65(44-49)66-45-50(56-34-18-38-64-62-36-16-32-54(72(62)77-74(56)64)47-21-6-2-7-22-47)40-42-68(66)75(67)52-26-14-25-51(43-52)70-59-29-12-10-27-57(59)69(48-23-8-3-9-24-48)58-28-11-13-30-60(58)70;1-4-18-46(19-5-1)53-28-14-32-61-63-34-16-30-55(73(63)76-71(53)61)50-38-42-67-65(44-50)66-45-51(56-31-17-35-64-62-33-15-29-54(72(62)77-74(56)64)47-20-6-2-7-21-47)39-43-68(66)75(67)52-40-36-49(37-41-52)70-59-26-12-10-24-57(59)69(48-22-8-3-9-23-48)58-25-11-13-27-60(58)70;1-4-16-40(17-5-1)44-31-35-59-55(36-44)56-39-46(41-18-6-2-7-19-41)38-53(62(56)64-59)45-30-34-58-54(37-45)48-22-14-15-27-57(48)63(58)47-32-28-43(29-33-47)61-51-25-12-10-23-49(51)60(42-20-8-3-9-21-42)50-24-11-13-26-52(50)61/h1-53H;2*1-45H;1-39H |
| InChIKey | BIAGNVGTRCRZRL-UHFFFAOYSA-N |
| XLogP | 83.33 |
| TPSA | 111.70 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 29 |
| Heavy Atoms | 307 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3906.73 |
| LogP ≤ 5 | 83.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |