C130H105N9O3SSi5 — CID 157170406
[4-([1]benzofuro[2,3-b]pyrrol-3-yl)phenyl]-methyl-diphenylsilane;(4-furo[2,3-b]indol-4-ylphenyl)-methyl-diphenylsilane;(4-imidazo[1,2-a]benzimidazol-3-ylphenyl)-methyl-diphenylsilane;methyl-diphenyl-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane;methyl-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane (PubChem CID 157170406) has the molecular formula C130H105N9O3SSi5 and a molecular weight of 2013.83 g/mol. Its IUPAC name is [4-([1]benzofuro[2,3-b]pyrrol-3-yl)phenyl]-methyl-diphenylsilane;(4-furo[2,3-b]indol-4-ylphenyl)-methyl-diphenylsilane;(4-imidazo[1,2-a]benzimidazol-3-ylphenyl)-methyl-diphenylsilane;methyl-diphenyl-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane;methyl-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane.
| Compound Name | [4-([1]benzofuro[2,3-b]pyrrol-3-yl)phenyl]-methyl-diphenylsilane;(4-furo[2,3-b]indol-4-ylphenyl)-methyl-diphenylsilane;(4-imidazo[1,2-a]benzimidazol-3-ylphenyl)-methyl-diphenylsilane;methyl-diphenyl-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane;methyl-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane |
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| PubChem CID | 157170406 |
| Molecular Formula | C130H105N9O3SSi5 |
| Molecular Weight | 2013.83 g/mol |
| Exact Mass | 2011.69 |
| IUPAC Name | [4-([1]benzofuro[2,3-b]pyrrol-3-yl)phenyl]-methyl-diphenylsilane;(4-furo[2,3-b]indol-4-ylphenyl)-methyl-diphenylsilane;(4-imidazo[1,2-a]benzimidazol-3-ylphenyl)-methyl-diphenylsilane;methyl-diphenyl-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane;methyl-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane |
| SMILES | C[Si](c1ccccc1)(c1ccccc1)c1ccc(-n2c3ccccc3c3ccoc32)cc1.C[Si](c1ccccc1)(c1ccccc1)c1ccc(-n2ccc3c4ccccc4oc32)cc1.C[Si](c1ccccc1)(c1ccccc1)c1ccc(-n2ccn3c4ccccc4nc23)cc1.C[Si](c1ccccc1)(c1ccccc1)c1ccc2nc3occn3c2c1.C[Si](c1ccccc1)(c1ccccc1)c1ccc2nc3sccn3c2c1 |
| InChI | InChI=1S/2C29H23NOSi.C28H23N3Si.C22H18N2OSi.C22H18N2SSi/c1-32(23-10-4-2-5-11-23,24-12-6-3-7-13-24)25-18-16-22(17-19-25)30-28-15-9-8-14-26(28)27-20-21-31-29(27)30;1-32(23-10-4-2-5-11-23,24-12-6-3-7-13-24)25-18-16-22(17-19-25)30-21-20-27-26-14-8-9-15-28(26)31-29(27)30;1-32(23-10-4-2-5-11-23,24-12-6-3-7-13-24)25-18-16-22(17-19-25)30-20-21-31-27-15-9-8-14-26(27)29-28(30)31;2*1-26(17-8-4-2-5-9-17,18-10-6-3-7-11-18)19-12-13-20-21(16-19)24-14-15-25-22(24)23-20/h3*2-21H,1H3;2*2-16H,1H3 |
| InChIKey | ANKADIRFNLDSDH-UHFFFAOYSA-N |
| XLogP | 22.16 |
| TPSA | 106.11 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 13 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 148 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2013.83 |
| LogP ≤ 5 | 22.16 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 13 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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