C270H180N10O5Si5 — CID 158577794
[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane (PubChem CID 158577794) has the molecular formula C270H180N10O5Si5 and a molecular weight of 3784.90 g/mol. Its IUPAC name is [3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane.
| Compound Name | [3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane |
|---|---|
| PubChem CID | 158577794 |
| Molecular Formula | C270H180N10O5Si5 |
| Molecular Weight | 3784.90 g/mol |
| Exact Mass | 3781.30 |
| IUPAC Name | [3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane |
| SMILES | c1ccc([Si](c2ccccc2)(c2ccc(-n3c4ccccc4c4ccc5c6ccccc6oc5c43)cc2)c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc(-n3c4ccccc4c4ccc5c6ccccc6oc5c43)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-n3c4ccccc4c4ccccc43)c2)c2cccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c2)cc1 |
| InChI | InChI=1S/5C54H36N2OSi/c1-3-19-39(20-4-1)58(40-21-5-2-6-22-40,41-23-15-17-37(35-41)55-48-29-11-7-25-43(48)44-26-8-12-30-49(44)55)42-24-16-18-38(36-42)56-50-31-13-9-28-47(50)53-51(56)34-33-46-45-27-10-14-32-52(45)57-54(46)53;1-3-17-39(18-4-1)58(40-19-5-2-6-20-40,41-32-30-37(31-33-41)55-48-26-11-7-22-43(48)44-23-8-12-27-49(44)55)42-21-15-16-38(36-42)56-50-28-13-9-25-47(50)53-51(56)35-34-46-45-24-10-14-29-52(45)57-54(46)53;1-3-17-39(18-4-1)58(40-19-5-2-6-20-40,41-32-30-37(31-33-41)55-48-26-11-7-22-43(48)44-23-8-12-27-49(44)55)42-21-15-16-38(36-42)56-50-28-13-9-24-45(50)46-34-35-52-53(54(46)56)47-25-10-14-29-51(47)57-52;1-3-17-39(18-4-1)58(40-19-5-2-6-20-40,42-21-15-16-38(36-42)55-49-26-11-7-22-43(49)44-23-8-12-27-50(44)55)41-32-30-37(31-33-41)56-51-28-13-9-24-45(51)47-34-35-48-46-25-10-14-29-52(46)57-54(48)53(47)56;1-3-17-39(18-4-1)58(40-19-5-2-6-20-40,41-32-30-37(31-33-41)55-49-26-11-7-22-43(49)44-23-8-12-27-50(44)55)42-21-15-16-38(36-42)56-51-28-13-9-24-45(51)47-34-35-48-46-25-10-14-29-52(46)57-54(48)53(47)56/h5*1-36H |
| InChIKey | HSWJPSSGXYARGO-UHFFFAOYSA-N |
| XLogP | 55.79 |
| TPSA | 115.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 290 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3784.90 |
| LogP ≤ 5 | 55.79 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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