C208H156N4Si4 — CID 160575058
N-(4-trimethylsilylphenyl)-N-triphenylen-1-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-3-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-4-amine (PubChem CID 160575058) has the molecular formula C208H156N4Si4 and a molecular weight of 2823.91 g/mol. Its IUPAC name is N-(4-trimethylsilylphenyl)-N-triphenylen-1-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-3-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-4-amine.
| Compound Name | N-(4-trimethylsilylphenyl)-N-triphenylen-1-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-3-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-4-amine |
|---|---|
| PubChem CID | 160575058 |
| Molecular Formula | C208H156N4Si4 |
| Molecular Weight | 2823.91 g/mol |
| Exact Mass | 2821.14 |
| IUPAC Name | N-(4-trimethylsilylphenyl)-N-triphenylen-1-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-3-amine;N-(4-trimethylsilylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-4-amine |
| SMILES | C[Si](C)(C)c1ccc(N(c2ccc3c(c2)-c2ccccc2C32c3ccccc3-c3ccccc32)c2ccc3c4ccccc4c4ccccc4c3c2)cc1.C[Si](C)(C)c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c2ccc3c4ccccc4c4ccccc4c3c2)cc1.C[Si](C)(C)c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c2cccc3c4ccccc4c4ccccc4c23)cc1.C[Si](C)(C)c1ccc(N(c2ccc3c4ccccc4c4ccccc4c3c2)c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1 |
| InChI | InChI=1S/4C52H39NSi/c1-54(2,3)36-30-27-34(28-31-36)53(35-29-32-41-39-17-5-4-15-37(39)38-16-6-7-18-40(38)45(41)33-35)50-26-14-25-49-51(50)44-21-10-13-24-48(44)52(49)46-22-11-8-19-42(46)43-20-9-12-23-47(43)52;1-54(2,3)36-30-27-34(28-31-36)53(50-26-14-22-45-39-16-5-4-15-37(39)38-17-6-7-21-44(38)51(45)50)35-29-32-43-42-20-10-13-25-48(42)52(49(43)33-35)46-23-11-8-18-40(46)41-19-9-12-24-47(41)52;1-54(2,3)37-28-24-34(25-29-37)53(35-26-30-42-40-16-5-4-14-38(40)39-15-6-7-17-41(39)46(42)32-35)36-27-31-51-47(33-36)45-20-10-13-23-50(45)52(51)48-21-11-8-18-43(48)44-19-9-12-22-49(44)52;1-54(2,3)37-28-24-34(25-29-37)53(35-26-30-42-40-16-5-4-14-38(40)39-15-6-7-17-41(39)47(42)32-35)36-27-31-46-45-20-10-13-23-50(45)52(51(46)33-36)48-21-11-8-18-43(48)44-19-9-12-22-49(44)52/h4*4-33H,1-3H3 |
| InChIKey | RBANMHSSBAJGHA-UHFFFAOYSA-N |
| XLogP | 54.02 |
| TPSA | 12.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 216 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2823.91 |
| LogP ≤ 5 | 54.02 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
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