C161H97N3O9 — CID 157265622
N-dibenzofuran-3-yl-N-(4-naphthalen-1-ylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylnaphthalen-1-yl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine (PubChem CID 157265622) has the molecular formula C161H97N3O9 and a molecular weight of 2217.56 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N-(4-naphthalen-1-ylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylnaphthalen-1-yl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine.
| Compound Name | N-dibenzofuran-3-yl-N-(4-naphthalen-1-ylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylnaphthalen-1-yl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine |
|---|---|
| PubChem CID | 157265622 |
| Molecular Formula | C161H97N3O9 |
| Molecular Weight | 2217.56 g/mol |
| Exact Mass | 2215.72 |
| IUPAC Name | N-dibenzofuran-3-yl-N-(4-naphthalen-1-ylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylnaphthalen-1-yl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine;N-dibenzofuran-3-yl-N-(4-phenylphenyl)spiro[[1]benzofuro[3,2-b]chromene-11,9'-fluorene]-3-amine |
| SMILES | c1ccc(-c2ccc(N(c3ccc4c(c3)Oc3c(oc5ccccc35)C43c4ccccc4-c4ccccc43)c3ccc4c(c3)oc3ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)Oc3c(oc5ccccc35)C43c4ccccc4-c4ccccc43)c3ccc4c(c3)oc3ccccc34)cc2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)oc3ccccc34)cc2Oc2c1oc1ccccc21 |
| InChI | InChI=1S/2C55H33NO3.C51H31NO3/c1-2-14-39-34(12-1)13-11-19-40(39)35-24-26-36(27-25-35)56(37-28-30-44-43-17-5-9-22-49(43)57-51(44)32-37)38-29-31-48-52(33-38)58-53-45-18-6-10-23-50(45)59-54(53)55(48)46-20-7-3-15-41(46)42-16-4-8-21-47(42)55;1-2-14-34(15-3-1)37-29-31-48(41-19-5-4-16-38(37)41)56(35-26-28-43-42-20-8-12-24-49(42)57-51(43)32-35)36-27-30-47-52(33-36)58-53-44-21-9-13-25-50(44)59-54(53)55(47)45-22-10-6-17-39(45)40-18-7-11-23-46(40)55;1-2-12-32(13-3-1)33-22-24-34(25-23-33)52(35-26-28-40-39-16-6-10-20-45(39)53-47(40)30-35)36-27-29-44-48(31-36)54-49-41-17-7-11-21-46(41)55-50(49)51(44)42-18-8-4-14-37(42)38-15-5-9-19-43(38)51/h2*1-33H;1-31H |
| InChIKey | AXYPHSDYLQFORT-UHFFFAOYSA-N |
| XLogP | 44.12 |
| TPSA | 116.25 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 173 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2217.56 |
| LogP ≤ 5 | 44.12 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |