C212H140N6OS2 — CID 158548002
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (PubChem CID 158548002) 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]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.
| Compound Name | N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine |
|---|---|
| PubChem CID | 158548002 |
| 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]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3cccc4c3-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)cc21.c1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cccc43)c3ccccc32)cc1.c1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccc(-c6ccc7sc8ccccc8c7c6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cccc43)c3ccccc32)cc1 |
| InChI | InChI=1S/C74H48N2O.C74H48N2S.C64H44N2S/c2*1-4-21-51(22-5-1)73(52-23-6-2-7-24-52)61-30-13-10-27-56(61)57-45-44-55(48-66(57)73)75(54-42-39-49(40-43-54)50-41-46-71-60(47-50)58-28-12-19-38-70(58)77-71)69-37-20-34-65-72(69)59-29-11-14-31-62(59)74(65)63-32-15-17-35-67(63)76(53-25-8-3-9-26-53)68-36-18-16-33-64(68)74;1-63(2)51-22-9-6-19-46(51)47-37-36-45(40-56(47)63)65(44-34-31-41(32-35-44)42-33-38-61-50(39-42)48-20-8-15-30-60(48)67-61)59-29-16-26-55-62(59)49-21-7-10-23-52(49)64(55)53-24-11-13-27-57(53)66(43-17-4-3-5-18-43)58-28-14-12-25-54(58)64/h2*1-48H;3-40H,1-2H3 |
| InChIKey | HPJGBPMTBOPLBC-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 |