C256H173N9 — CID 159276468
2,4-diphenyl-6-[4-(4-spiro[4,4a-dihydrofluorene-9,9'-fluorene]-3'-ylphenyl)phenyl]pyridine;2,4-diphenyl-6-[3-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2,4-diphenyl-6-[4-[3-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2-[3-[3-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 159276468) has the molecular formula C256H173N9 and a molecular weight of 3375.26 g/mol. Its IUPAC name is 2,4-diphenyl-6-[4-(4-spiro[4,4a-dihydrofluorene-9,9'-fluorene]-3'-ylphenyl)phenyl]pyridine;2,4-diphenyl-6-[3-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2,4-diphenyl-6-[4-[3-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2-[3-[3-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine.
| Compound Name | 2,4-diphenyl-6-[4-(4-spiro[4,4a-dihydrofluorene-9,9'-fluorene]-3'-ylphenyl)phenyl]pyridine;2,4-diphenyl-6-[3-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2,4-diphenyl-6-[4-[3-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2-[3-[3-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine |
|---|---|
| PubChem CID | 159276468 |
| Molecular Formula | C256H173N9 |
| Molecular Weight | 3375.26 g/mol |
| Exact Mass | 3372.38 |
| IUPAC Name | 2,4-diphenyl-6-[4-(4-spiro[4,4a-dihydrofluorene-9,9'-fluorene]-3'-ylphenyl)phenyl]pyridine;2,4-diphenyl-6-[3-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2,4-diphenyl-6-[4-[3-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2-[3-[3-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine |
| SMILES | C1=CCC2C(=C1)C1(c3ccccc3-c3cc(-c4ccc(-c5ccc(-c6cc(-c7ccccc7)cc(-c7ccccc7)n6)cc5)cc4)ccc31)c1ccccc12.CC1(c2ccccc2)c2ccccc2-c2ccc(-c3ccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3)cc21.CC1(c2ccccc2)c2ccccc2-c2ccc(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c3)cc21.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cccc(-c5ccc6c(c5)-c5ccccc5C65c6ccccc6-c6ccccc65)c4)cc3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5ccc6c(c5)-c5ccccc5C65c6ccccc6-c6ccccc65)cc4)c3)c2)cc1 |
| InChI | InChI=1S/2C54H35N.C54H37N.2C47H33N3/c1-3-14-36(15-4-1)43-34-52(39-16-5-2-6-17-39)55-53(35-43)42-19-13-18-40(32-42)37-26-28-38(29-27-37)41-30-31-51-47(33-41)46-22-9-12-25-50(46)54(51)48-23-10-7-20-44(48)45-21-8-11-24-49(45)54;1-3-14-36(15-4-1)43-34-52(38-16-5-2-6-17-38)55-53(35-43)39-28-26-37(27-29-39)40-18-13-19-41(32-40)42-30-31-51-47(33-42)46-22-9-12-25-50(46)54(51)48-23-10-7-20-44(48)45-21-8-11-24-49(45)54;1-3-13-36(14-4-1)43-34-52(40-15-5-2-6-16-40)55-53(35-43)41-29-27-38(28-30-41)37-23-25-39(26-24-37)42-31-32-51-47(33-42)46-19-9-12-22-50(46)54(51)48-20-10-7-17-44(48)45-18-8-11-21-49(45)54;1-47(39-23-9-4-10-24-39)42-26-12-11-25-40(42)41-28-27-37(31-43(41)47)35-20-13-19-34(29-35)36-21-14-22-38(30-36)46-49-44(32-15-5-2-6-16-32)48-45(50-46)33-17-7-3-8-18-33;1-47(39-20-9-4-10-21-39)42-23-12-11-22-40(42)41-29-28-37(31-43(41)47)33-26-24-32(25-27-33)36-18-13-19-38(30-36)46-49-44(34-14-5-2-6-15-34)48-45(50-46)35-16-7-3-8-17-35/h2*1-35H;1-17,19-35,45H,18H2;2*2-31H,1H3 |
| InChIKey | KYJDNXJZDYWLNA-UHFFFAOYSA-N |
| XLogP | 64.32 |
| TPSA | 116.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 265 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3375.26 |
| LogP ≤ 5 | 64.32 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |