C212H140N6OS2 — CID 158809478
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine (PubChem CID 158809478) has the molecular formula C212H140N6OS2 and a molecular weight of 2851.63 g/mol. Its IUPAC name is N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine.
| Compound Name | N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine |
|---|---|
| PubChem CID | 158809478 |
| Molecular Formula | C212H140N6OS2 |
| Molecular Weight | 2851.63 g/mol |
| Exact Mass | 2849.05 |
| IUPAC Name | N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)cc21.c1ccc(N2c3ccccc3C3(c4ccccc4-c4ccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cc43)c3ccccc32)cc1.c1ccc(N2c3ccccc3C3(c4ccccc4-c4ccc(N(c5ccc(-c6ccc7sc8ccccc8c7c6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cc43)c3ccccc32)cc1 |
| InChI | InChI=1S/C74H48N2O.C74H48N2S.C64H44N2S/c2*1-4-20-51(21-5-1)73(52-22-6-2-7-23-52)63-29-13-10-26-57(63)59-43-41-55(47-67(59)73)75(54-39-36-49(37-40-54)50-38-45-72-62(46-50)61-28-12-19-35-71(61)77-72)56-42-44-60-58-27-11-14-30-64(58)74(68(60)48-56)65-31-15-17-33-69(65)76(53-24-8-3-9-25-53)70-34-18-16-32-66(70)74;1-63(2)53-21-9-6-18-47(53)49-35-33-45(39-57(49)63)65(44-31-28-41(29-32-44)42-30-37-62-52(38-42)51-20-8-15-27-61(51)67-62)46-34-36-50-48-19-7-10-22-54(48)64(58(50)40-46)55-23-11-13-25-59(55)66(43-16-4-3-5-17-43)60-26-14-12-24-56(60)64/h2*1-48H;3-40H,1-2H3 |
| InChIKey | IUMNQAVECKDJDK-UHFFFAOYSA-N |
| XLogP | 56.58 |
| TPSA | 32.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 221 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2851.63 |
| LogP ≤ 5 | 56.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |