C162H204N8O8Pt4Si6-4 — CID 158597304
bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol);bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-6-trimethylsilyl-1,3-benzoxazol-2-yl]phenol);platinum (PubChem CID 158597304) has the molecular formula C162H204N8O8Pt4Si6-4 and a molecular weight of 3340.29 g/mol. Its IUPAC name is bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol);bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-6-trimethylsilyl-1,3-benzoxazol-2-yl]phenol);platinum.
| Compound Name | bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol);bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-6-trimethylsilyl-1,3-benzoxazol-2-yl]phenol);platinum |
|---|---|
| PubChem CID | 158597304 |
| Molecular Formula | C162H204N8O8Pt4Si6-4 |
| Molecular Weight | 3340.29 g/mol |
| Exact Mass | 3337.30 |
| IUPAC Name | bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol);bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-6-trimethylsilyl-1,3-benzoxazol-2-yl]phenol);platinum |
| SMILES | CC(C)(C)c1cc(-c2cc([Si](C)(C)C)ccn2)[c-]c(-c2cc([Si](C)(C)C)cc3oc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4O)nc23)c1.CC(C)(C)c1cc(-c2cc([Si](C)(C)C)ccn2)[c-]c(-c2cc([Si](C)(C)C)cc3oc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4O)nc23)c1.CC(C)(C)c1cc(-c2ccc([Si](C)(C)C)cn2)[c-]c(-c2cccc3oc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4O)nc23)c1.CC(C)(C)c1cc(-c2ccc([Si](C)(C)C)cn2)[c-]c(-c2cccc3oc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4O)nc23)c1.[Pt].[Pt].[Pt].[Pt] |
| InChI | InChI=1S/2C42H55N2O2Si2.2C39H47N2O2Si.4Pt/c2*1-40(2,3)28-19-26(18-27(20-28)35-24-30(16-17-43-35)47(10,11)12)32-23-31(48(13,14)15)25-36-37(32)44-39(46-36)33-21-29(41(4,5)6)22-34(38(33)45)42(7,8)9;2*1-37(2,3)26-19-24(18-25(20-26)32-17-16-28(23-40-32)44(10,11)12)29-14-13-15-33-34(29)41-36(43-33)30-21-27(38(4,5)6)22-31(35(30)42)39(7,8)9;;;;/h2*16-17,19-25,45H,1-15H3;2*13-17,19-23,42H,1-12H3;;;;/q4*-1;;;; |
| InChIKey | BHRFWYRHZYLNQS-UHFFFAOYSA-N |
| XLogP | 41.75 |
| TPSA | 236.60 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 188 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3340.29 |
| LogP ≤ 5 | 41.75 |
| 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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