C180H109N3O8 — CID 158083207
N-dibenzofuran-2-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-dibenzofuran-4-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-phenyl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine (PubChem CID 158083207) has the molecular formula C180H109N3O8 and a molecular weight of 2441.86 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-dibenzofuran-4-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-phenyl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine.
| Compound Name | N-dibenzofuran-2-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-dibenzofuran-4-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-phenyl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine |
|---|---|
| PubChem CID | 158083207 |
| Molecular Formula | C180H109N3O8 |
| Molecular Weight | 2441.86 g/mol |
| Exact Mass | 2439.82 |
| IUPAC Name | N-dibenzofuran-2-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-dibenzofuran-4-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-phenyl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-3-amine |
| SMILES | c1ccc(N(c2ccc3c(c2)-c2ccccc2C32c3ccccc3Oc3ccccc32)c2ccc3c(c2)-c2ccccc2C32c3ccccc3Oc3ccccc32)cc1.c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C43c4ccccc4Oc4ccccc43)c3ccc4oc5ccccc5c4c3)ccc21.c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C43c4ccccc4Oc4ccccc43)c3cccc4c3oc3ccccc34)ccc21 |
| InChI | InChI=1S/2C62H37NO3.C56H35NO2/c1-4-20-46-40(16-1)44-36-38(32-34-48(44)61(46)50-22-6-11-28-56(50)64-57-29-12-7-23-51(57)61)63(54-26-15-19-43-42-18-3-10-27-55(42)66-60(43)54)39-33-35-49-45(37-39)41-17-2-5-21-47(41)62(49)52-24-8-13-30-58(52)65-59-31-14-9-25-53(59)62;1-4-18-47-41(15-1)44-35-38(29-32-49(44)61(47)51-20-6-11-25-57(51)65-58-26-12-7-21-52(58)61)63(40-31-34-56-46(37-40)43-17-3-10-24-55(43)64-56)39-30-33-50-45(36-39)42-16-2-5-19-48(42)62(50)53-22-8-13-27-59(53)66-60-28-14-9-23-54(60)62;1-2-16-36(17-3-1)57(37-30-32-45-41(34-37)39-18-4-6-20-43(39)55(45)47-22-8-12-26-51(47)58-52-27-13-9-23-48(52)55)38-31-33-46-42(35-38)40-19-5-7-21-44(40)56(46)49-24-10-14-28-53(49)59-54-29-15-11-25-50(54)56/h2*1-37H;1-35H |
| InChIKey | FNEXBELGKGMBMU-UHFFFAOYSA-N |
| XLogP | 46.08 |
| TPSA | 91.38 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 191 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2441.86 |
| LogP ≤ 5 | 46.08 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |