C229H141N7 — CID 159743145
2,6-diphenyl-4-(4-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylphenyl)pyridine;9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole;8-(6-phenyl-4-spiro[benzo[c]fluorene-7,9'-fluorene]-4'-yl-2-pyridinyl)quinoline;4-phenyl-2-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylquinazoline;2-spiro[benzo[g]fluorene-7,9'-fluorene]-9-ylquinoline (PubChem CID 159743145) has the molecular formula C229H141N7 and a molecular weight of 2990.70 g/mol. Its IUPAC name is 2,6-diphenyl-4-(4-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylphenyl)pyridine;9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole;8-(6-phenyl-4-spiro[benzo[c]fluorene-7,9'-fluorene]-4'-yl-2-pyridinyl)quinoline;4-phenyl-2-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylquinazoline;2-spiro[benzo[g]fluorene-7,9'-fluorene]-9-ylquinoline.
| Compound Name | 2,6-diphenyl-4-(4-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylphenyl)pyridine;9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole;8-(6-phenyl-4-spiro[benzo[c]fluorene-7,9'-fluorene]-4'-yl-2-pyridinyl)quinoline;4-phenyl-2-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylquinazoline;2-spiro[benzo[g]fluorene-7,9'-fluorene]-9-ylquinoline |
|---|---|
| PubChem CID | 159743145 |
| Molecular Formula | C229H141N7 |
| Molecular Weight | 2990.70 g/mol |
| Exact Mass | 2988.12 |
| IUPAC Name | 2,6-diphenyl-4-(4-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylphenyl)pyridine;9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole;8-(6-phenyl-4-spiro[benzo[c]fluorene-7,9'-fluorene]-4'-yl-2-pyridinyl)quinoline;4-phenyl-2-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylquinazoline;2-spiro[benzo[g]fluorene-7,9'-fluorene]-9-ylquinoline |
| SMILES | c1ccc(-c2cc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-c5c4ccc4ccccc54)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4c3ccc3ccccc43)cc(-c3cccc4cccnc34)n2)cc1.c1ccc(-c2nc(-c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4-c4c3ccc3ccccc43)nc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-c5c4ccc4ccccc54)ccc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2cc(-c3ccc4ccccc4n3)ccc2-c2c1ccc1ccccc21 |
| InChI | InChI=1S/C52H33N.C49H30N2.C47H29N.C43H26N2.C38H23N/c1-3-14-37(15-4-1)49-32-40(33-50(53-49)38-16-5-2-6-17-38)35-25-23-34(24-26-35)39-27-29-43-42-19-9-11-21-45(42)52(48(43)31-39)46-22-12-10-20-44(46)51-41-18-8-7-13-36(41)28-30-47(51)52;1-2-14-32(15-3-1)44-29-34(30-45(51-44)39-22-10-16-33-17-12-28-50-48(33)39)36-21-11-25-42-47(36)38-20-7-9-24-41(38)49(42)40-23-8-6-19-37(40)46-35-18-5-4-13-31(35)26-27-43(46)49;1-2-13-33(14-3-1)48-44-21-11-8-17-37(44)39-28-31(24-27-45(39)48)32-22-25-36-35-16-6-9-19-40(35)47(43(36)29-32)41-20-10-7-18-38(41)46-34-15-5-4-12-30(34)23-26-42(46)47;1-2-13-28(14-3-1)41-34-18-8-11-21-39(34)44-42(45-41)29-22-24-32-31-16-6-9-19-35(31)43(38(32)26-29)36-20-10-7-17-33(36)40-30-15-5-4-12-27(30)23-25-37(40)43;1-3-11-27-24(9-1)18-21-33-37(27)30-20-17-26(36-22-19-25-10-2-8-16-35(25)39-36)23-34(30)38(33)31-14-6-4-12-28(31)29-13-5-7-15-32(29)38/h1-33H;1-30H;1-29H;1-26H;1-23H |
| InChIKey | NCSBUHOXSDJGRH-UHFFFAOYSA-N |
| XLogP | 57.18 |
| TPSA | 82.27 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 236 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2990.70 |
| LogP ≤ 5 | 57.18 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |