C112H104N12O4Pt4Si4-4 — CID 157222173
bis(2-[1-methyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-trimethylsilylbenzimidazol-2-yl]phenol);bis(2-[1-methyl-4-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol);platinum (PubChem CID 157222173) has the molecular formula C112H104N12O4Pt4Si4-4 and a molecular weight of 2574.80 g/mol. Its IUPAC name is bis(2-[1-methyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-trimethylsilylbenzimidazol-2-yl]phenol);bis(2-[1-methyl-4-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol);platinum.
| Compound Name | bis(2-[1-methyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-trimethylsilylbenzimidazol-2-yl]phenol);bis(2-[1-methyl-4-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol);platinum |
|---|---|
| PubChem CID | 157222173 |
| Molecular Formula | C112H104N12O4Pt4Si4-4 |
| Molecular Weight | 2574.80 g/mol |
| Exact Mass | 2572.60 |
| IUPAC Name | bis(2-[1-methyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-trimethylsilylbenzimidazol-2-yl]phenol);bis(2-[1-methyl-4-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol);platinum |
| SMILES | Cn1c(-c2ccccc2O)nc2c(-c3[c-]c(-c4cc([Si](C)(C)C)ccn4)ccc3)cccc21.Cn1c(-c2ccccc2O)nc2c(-c3[c-]c(-c4cc([Si](C)(C)C)ccn4)ccc3)cccc21.Cn1c(-c2ccccc2O)nc2c(-c3[c-]c(-c4ccccn4)ccc3)cc([Si](C)(C)C)cc21.Cn1c(-c2ccccc2O)nc2c(-c3[c-]c(-c4ccccn4)ccc3)cc([Si](C)(C)C)cc21.[Pt].[Pt].[Pt].[Pt] |
| InChI | InChI=1S/4C28H26N3OSi.4Pt/c2*1-31-25-13-8-12-22(27(25)30-28(31)23-11-5-6-14-26(23)32)19-9-7-10-20(17-19)24-18-21(15-16-29-24)33(2,3)4;2*1-31-25-18-21(33(2,3)4)17-23(27(25)30-28(31)22-12-5-6-14-26(22)32)19-10-9-11-20(16-19)24-13-7-8-15-29-24;;;;/h2*5-16,18,32H,1-4H3;2*5-15,17-18,32H,1-4H3;;;;/q4*-1;;;; |
| InChIKey | URSHVSJIEBXKCD-UHFFFAOYSA-N |
| XLogP | 24.07 |
| TPSA | 203.76 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 136 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2574.80 |
| LogP ≤ 5 | 24.07 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 16 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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