C208H132N12 — CID 159399001
2,4-bis(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine (PubChem CID 159399001) has the molecular formula C208H132N12 and a molecular weight of 2799.43 g/mol. Its IUPAC name is 2,4-bis(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine.
| Compound Name | 2,4-bis(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine |
|---|---|
| PubChem CID | 159399001 |
| Molecular Formula | C208H132N12 |
| Molecular Weight | 2799.43 g/mol |
| Exact Mass | 2797.07 |
| IUPAC Name | 2,4-bis(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine |
| SMILES | c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5cccc6c5-c5ccccc5C65c6ccccc6-c6ccccc65)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5-c5ccccc5C65c6ccccc6-c6ccccc65)cc4)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5-c5ccccc5C65c6ccccc6-c6ccccc65)cc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)n2)cc1 |
| InChI | InChI=1S/C58H37N3.2C52H33N3.C46H29N3/c1-3-14-38(15-4-1)40-26-32-43(33-27-40)55-59-56(44-34-28-41(29-35-44)39-16-5-2-6-17-39)61-57(60-55)45-36-30-42(31-37-45)46-21-13-25-53-54(46)49-20-9-12-24-52(49)58(53)50-22-10-7-18-47(50)48-19-8-11-23-51(48)58;1-3-15-34(16-4-1)38-19-13-20-39(33-38)51-54-49(36-17-5-2-6-18-36)53-50(55-51)37-31-29-35(30-32-37)40-24-14-28-47-48(40)43-23-9-12-27-46(43)52(47)44-25-10-7-21-41(44)42-22-8-11-26-45(42)52;1-3-14-34(15-4-1)35-26-30-38(31-27-35)50-53-49(37-16-5-2-6-17-37)54-51(55-50)39-32-28-36(29-33-39)40-21-13-25-47-48(40)43-20-9-12-24-46(43)52(47)44-22-10-7-18-41(44)42-19-8-11-23-45(42)52;1-3-14-31(15-4-1)43-47-44(32-16-5-2-6-17-32)49-45(48-43)33-28-26-30(27-29-33)34-21-13-25-41-42(34)37-20-9-12-24-40(37)46(41)38-22-10-7-18-35(38)36-19-8-11-23-39(36)46/h1-37H;2*1-33H;1-29H |
| InChIKey | LNCFVKOBKLRYGM-UHFFFAOYSA-N |
| XLogP | 50.20 |
| TPSA | 154.68 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 220 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2799.43 |
| LogP ≤ 5 | 50.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |