C87H63N5OPt4S2+4 — CID 159250707
1-methyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;tetrakis(platinum(2+)) (PubChem CID 159250707) has the molecular formula C87H63N5OPt4S2+4 and a molecular weight of 2038.94 g/mol. Its IUPAC name is 1-methyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;tetrakis(platinum(2+)).
| Compound Name | 1-methyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;tetrakis(platinum(2+)) |
|---|---|
| PubChem CID | 159250707 |
| Molecular Formula | C87H63N5OPt4S2+4 |
| Molecular Weight | 2038.94 g/mol |
| Exact Mass | 2037.30 |
| IUPAC Name | 1-methyl-2-phenyl-5-(4-phenylphenyl)imidazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;2-phenyl-5-(4-phenylphenyl)-1,3-thiazole;tetrakis(platinum(2+)) |
| SMILES | Cc1nc(-c2[c-]cccc2)oc1-c1ccc(-c2ccccc2)cc1.Cc1nc(-c2[c-]cccc2)sc1-c1ccc(-c2ccccc2)cc1.Cn1c(-c2ccc(-c3ccccc3)cc2)cnc1-c1[c-]cccc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1ccccc1-c1ncc(-c2ccc(-c3ccccc3)cc2)s1 |
| InChI | InChI=1S/C22H17N2.C22H16NO.C22H16NS.C21H14NS.4Pt/c1-24-21(16-23-22(24)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;2*1-16-21(24-22(23-16)20-10-6-3-7-11-20)19-14-12-18(13-15-19)17-8-4-2-5-9-17;1-3-7-16(8-4-1)17-11-13-18(14-12-17)20-15-22-21(23-20)19-9-5-2-6-10-19;;;;/h2-10,12-16H,1H3;2*2-10,12-15H,1H3;1-9,11-15H;;;;/q4*-1;4*+2 |
| InChIKey | ZVXGFAVXERIZNQ-UHFFFAOYSA-N |
| XLogP | 23.19 |
| TPSA | 69.63 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 99 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2038.94 |
| LogP ≤ 5 | 23.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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