C192H130N8OSi3 — CID 158196682
[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]silane;diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane;diphenyl-[4-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane (PubChem CID 158196682) has the molecular formula C192H130N8OSi3 and a molecular weight of 2649.46 g/mol. Its IUPAC name is [4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]silane;diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane;diphenyl-[4-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane.
| Compound Name | [4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]silane;diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane;diphenyl-[4-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane |
|---|---|
| PubChem CID | 158196682 |
| Molecular Formula | C192H130N8OSi3 |
| Molecular Weight | 2649.46 g/mol |
| Exact Mass | 2646.97 |
| IUPAC Name | [4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]silane;diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane;diphenyl-[4-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane |
| SMILES | c1ccc(-n2c3ccccc3c3cc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccc(-n6c7ccccc7c7cc8c(cc76)c6ccccc6n8-c6ccccc6)cc5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc([Si](c5ccccc5)(c5ccccc5)c5ccc(-n6c7ccccc7c7cc8c(cc76)c6ccccc6n8-c6ccccc6)cc5)c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc([Si](c5ccccc5)(c5ccccc5)c5ccc(-n6c7ccccc7c7cc8oc9ccccc9c8cc76)cc5)c4)ccc32)cc1 |
| InChI | InChI=1S/2C66H45N3Si.C60H40N2OSi/c1-5-21-48(22-6-1)67-61-33-16-13-30-55(61)58-43-47(36-41-64(58)67)46-20-19-29-54(42-46)70(51-25-9-3-10-26-51,52-27-11-4-12-28-52)53-39-37-50(38-40-53)69-63-35-18-15-32-57(63)60-44-65-59(45-66(60)69)56-31-14-17-34-62(56)68(65)49-23-7-2-8-24-49;1-5-19-48(20-6-1)67-61-30-16-13-27-55(61)58-43-47(35-42-64(58)67)46-33-38-53(39-34-46)70(51-23-9-3-10-24-51,52-25-11-4-12-26-52)54-40-36-50(37-41-54)69-63-32-18-15-29-57(63)60-44-65-59(45-66(60)69)56-28-14-17-31-62(56)68(65)49-21-7-2-8-22-49;1-4-18-43(19-5-1)61-55-28-13-10-25-49(55)52-38-42(31-36-57(52)61)41-17-16-24-48(37-41)64(45-20-6-2-7-21-45,46-22-8-3-9-23-46)47-34-32-44(33-35-47)62-56-29-14-11-26-50(56)53-40-60-54(39-58(53)62)51-27-12-15-30-59(51)63-60/h2*1-45H;1-40H |
| InChIKey | GAKOLLIVCWTCRY-UHFFFAOYSA-N |
| XLogP | 40.87 |
| TPSA | 52.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 204 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2649.46 |
| LogP ≤ 5 | 40.87 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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