C165H124N6Si5 — CID 165013153
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane (PubChem CID 165013153) has the molecular formula C165H124N6Si5 and a molecular weight of 2331.28 g/mol. Its IUPAC name is [3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane.
| Compound Name | [3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane |
|---|---|
| PubChem CID | 165013153 |
| Molecular Formula | C165H124N6Si5 |
| Molecular Weight | 2331.28 g/mol |
| Exact Mass | 2328.87 |
| IUPAC Name | [3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane |
| SMILES | C[Si](C)(C)c1ccc2c(c1)c1cc(-n3c4ccccc4c4ccccc43)ccc1n2-c1cccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)ccc43)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1 |
| InChI | InChI=1S/C66H48N2Si2.C51H42N2Si2.C48H34N2Si/c1-7-25-51(26-8-1)69(52-27-9-2-10-28-52,53-29-11-3-12-30-53)57-37-23-24-49(46-57)67-65-44-42-50(68-63-40-21-19-38-59(63)60-39-20-22-41-64(60)68)47-61(65)62-48-58(43-45-66(62)67)70(54-31-13-4-14-32-54,55-33-15-5-16-34-55)56-35-17-6-18-36-56;1-54(2,3)42-31-33-51-47(36-42)46-35-38(53-48-28-15-13-26-44(48)45-27-14-16-29-49(45)53)30-32-50(46)52(51)37-18-17-25-43(34-37)55(39-19-7-4-8-20-39,40-21-9-5-10-22-40)41-23-11-6-12-24-41;1-4-18-37(19-5-1)51(38-20-6-2-7-21-38,39-22-8-3-9-23-39)40-24-16-17-35(33-40)49-47-30-15-12-27-43(47)44-34-36(31-32-48(44)49)50-45-28-13-10-25-41(45)42-26-11-14-29-46(42)50/h1-48H;4-36H,1-3H3;1-34H |
| InChIKey | JZVQNPDADNKNIW-UHFFFAOYSA-N |
| XLogP | 29.70 |
| TPSA | 29.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 176 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2331.28 |
| LogP ≤ 5 | 29.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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