C360H222N6O7S — CID 157153320
9,9-dimethyl-2,7-diphenyl-10-spiro[fluorene-9,12'-fluoreno[1,2-b][1]benzofuran]-4-ylacridine;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-3-ylcarbazole;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylcarbazole;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenothiazine;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenoxazine;N-[9-(2-methylphenyl)-9-phenylfluoren-4-yl]-N-(9,9'-spirobi[fluorene]-4-yl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-amine (PubChem CID 157153320) has the molecular formula C360H222N6O7S and a molecular weight of 4775.84 g/mol. Its IUPAC name is 9,9-dimethyl-2,7-diphenyl-10-spiro[fluorene-9,12'-fluoreno[1,2-b][1]benzofuran]-4-ylacridine;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-3-ylcarbazole;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylcarbazole;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenothiazine;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenoxazine;N-[9-(2-methylphenyl)-9-phenylfluoren-4-yl]-N-(9,9'-spirobi[fluorene]-4-yl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-amine.
| Compound Name | 9,9-dimethyl-2,7-diphenyl-10-spiro[fluorene-9,12'-fluoreno[1,2-b][1]benzofuran]-4-ylacridine;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-3-ylcarbazole;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylcarbazole;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenothiazine;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenoxazine;N-[9-(2-methylphenyl)-9-phenylfluoren-4-yl]-N-(9,9'-spirobi[fluorene]-4-yl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-amine |
|---|---|
| PubChem CID | 157153320 |
| Molecular Formula | C360H222N6O7S |
| Molecular Weight | 4775.84 g/mol |
| Exact Mass | 4771.69 |
| IUPAC Name | 9,9-dimethyl-2,7-diphenyl-10-spiro[fluorene-9,12'-fluoreno[1,2-b][1]benzofuran]-4-ylacridine;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-3-ylcarbazole;3,6-diphenyl-9-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylcarbazole;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenothiazine;3,7-diphenyl-10-spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-ylphenoxazine;N-[9-(2-methylphenyl)-9-phenylfluoren-4-yl]-N-(9,9'-spirobi[fluorene]-4-yl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-amine |
| SMILES | CC1(C)c2cc(-c3ccccc3)ccc2N(c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccc4c(oc5ccccc54)c32)c2ccc(-c3ccccc3)cc21.Cc1ccccc1C1(c2ccccc2)c2ccccc2-c2c(N(c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)c3cccc4c3-c3ccccc3C43c4ccccc4-c4c3ccc3c4oc4ccccc43)cccc21.c1ccc(-c2ccc3c(c2)Oc2cc(-c4ccccc4)ccc2N3c2cccc3c2-c2ccccc2C32c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4ccccc4)ccc2N3c2cccc3c2-c2ccccc2C32c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c(c2)-c2ccccc2C32c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc3c2-c2ccccc2C32c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1 |
| InChI | InChI=1S/C82H51NO.C58H39NO.C55H33NO2.C55H33NOS.2C55H33NO/c1-50-24-5-13-34-60(50)80(51-25-3-2-4-26-51)63-37-16-8-30-56(63)75-67(80)41-21-44-71(75)83(72-45-22-42-68-76(72)57-31-9-17-38-64(57)81(68)61-35-14-6-27-52(61)53-28-7-15-36-62(53)81)73-46-23-43-69-77(73)58-32-10-18-39-65(58)82(69)66-40-19-11-33-59(66)78-70(82)49-48-55-54-29-12-20-47-74(54)84-79(55)78;1-57(2)48-34-38(36-16-5-3-6-17-36)28-32-50(48)59(51-33-29-39(35-49(51)57)37-18-7-4-8-19-37)52-26-15-25-47-54(52)44-22-10-13-24-46(44)58(47)45-23-12-9-20-40(45)42-30-31-43-41-21-11-14-27-53(41)60-56(43)55(42)58;1-3-14-34(15-4-1)36-26-30-46-50(32-36)57-51-33-37(35-16-5-2-6-17-35)27-31-47(51)56(46)48-24-13-23-44-52(48)40-19-7-10-21-42(40)55(44)43-22-11-8-20-41(43)53-45(55)29-28-39-38-18-9-12-25-49(38)58-54(39)53;1-3-14-34(15-4-1)36-26-30-46-50(32-36)58-51-33-37(35-16-5-2-6-17-35)27-31-47(51)56(46)48-24-13-23-44-52(48)40-19-7-10-21-42(40)55(44)43-22-11-8-20-41(43)53-45(55)29-28-39-38-18-9-12-25-49(38)57-54(39)53;1-3-14-34(15-4-1)36-26-30-48-42(32-36)43-33-37(35-16-5-2-6-17-35)27-31-49(43)56(48)50-24-13-23-46-52(50)40-19-7-10-21-44(40)55(46)45-22-11-8-20-41(45)53-47(55)29-28-39-38-18-9-12-25-51(38)57-54(39)53;1-3-13-34(14-4-1)36-23-29-50-44(31-36)45-32-37(35-15-5-2-6-16-35)24-30-51(45)56(50)38-25-27-48-43(33-38)39-17-7-10-20-46(39)55(48)47-21-11-8-19-42(47)53-49(55)28-26-41-40-18-9-12-22-52(40)57-54(41)53/h2-49H,1H3;3-35H,1-2H3;2*1-33H;2*1-33H |
| InChIKey | ALMZISVXESUWLD-UHFFFAOYSA-N |
| XLogP | 94.55 |
| TPSA | 110.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 14 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 374 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4775.84 |
| LogP ≤ 5 | 94.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 14 |