C188H132N12O12Pt6 — CID 157051566
2-[9-(2-hydroxyphenyl)-4,7-dimethyl-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxyphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenol;2-[1-[3-(2-hydroxyphenyl)isoquinolin-1-yl]isoquinolin-3-yl]phenol;2-[6-[6-(2-hydroxyphenyl)-5-methyl-2-pyridinyl]-3-methyl-2-pyridinyl]phenol;2-[9-(2-hydroxyphenyl)-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxy-5-phenylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-4-phenylphenol;platinum (PubChem CID 157051566) has the molecular formula C188H132N12O12Pt6 and a molecular weight of 3921.66 g/mol. Its IUPAC name is 2-[9-(2-hydroxyphenyl)-4,7-dimethyl-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxyphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenol;2-[1-[3-(2-hydroxyphenyl)isoquinolin-1-yl]isoquinolin-3-yl]phenol;2-[6-[6-(2-hydroxyphenyl)-5-methyl-2-pyridinyl]-3-methyl-2-pyridinyl]phenol;2-[9-(2-hydroxyphenyl)-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxy-5-phenylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-4-phenylphenol;platinum.
| Compound Name | 2-[9-(2-hydroxyphenyl)-4,7-dimethyl-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxyphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenol;2-[1-[3-(2-hydroxyphenyl)isoquinolin-1-yl]isoquinolin-3-yl]phenol;2-[6-[6-(2-hydroxyphenyl)-5-methyl-2-pyridinyl]-3-methyl-2-pyridinyl]phenol;2-[9-(2-hydroxyphenyl)-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxy-5-phenylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-4-phenylphenol;platinum |
|---|---|
| PubChem CID | 157051566 |
| Molecular Formula | C188H132N12O12Pt6 |
| Molecular Weight | 3921.66 g/mol |
| Exact Mass | 3918.80 |
| IUPAC Name | 2-[9-(2-hydroxyphenyl)-4,7-dimethyl-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxyphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenol;2-[1-[3-(2-hydroxyphenyl)isoquinolin-1-yl]isoquinolin-3-yl]phenol;2-[6-[6-(2-hydroxyphenyl)-5-methyl-2-pyridinyl]-3-methyl-2-pyridinyl]phenol;2-[9-(2-hydroxyphenyl)-1,10-phenanthrolin-2-yl]phenol;2-[9-(2-hydroxy-5-phenylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]-4-phenylphenol;platinum |
| SMILES | Cc1cc(-c2ccccc2O)nc2c1ccc1c(C)cc(-c3ccccc3O)nc12.Cc1ccc(-c2ccc(C)c(-c3ccccc3O)n2)nc1-c1ccccc1O.Oc1ccc(-c2ccccc2)cc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4cc(-c5ccccc5)ccc4O)nc3c2n1.Oc1ccccc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4ccccc4O)nc3c2n1.Oc1ccccc1-c1cc2ccccc2c(-c2nc(-c3ccccc3O)cc3ccccc23)n1.Oc1ccccc1-c1ccc2ccc3ccc(-c4ccccc4O)nc3c2n1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt] |
| InChI | InChI=1S/C48H32N2O2.C36H24N2O2.C30H20N2O2.C26H20N2O2.C24H16N2O2.C24H20N2O2.6Pt/c51-45-25-21-35(31-13-5-1-6-14-31)27-41(45)43-29-39(33-17-9-3-10-18-33)37-23-24-38-40(34-19-11-4-12-20-34)30-44(50-48(38)47(37)49-43)42-28-36(22-26-46(42)52)32-15-7-2-8-16-32;39-33-17-9-7-15-27(33)31-21-29(23-11-3-1-4-12-23)25-19-20-26-30(24-13-5-2-6-14-24)22-32(38-36(26)35(25)37-31)28-16-8-10-18-34(28)40;33-27-15-7-5-13-23(27)25-17-19-9-1-3-11-21(19)29(31-25)30-22-12-4-2-10-20(22)18-26(32-30)24-14-6-8-16-28(24)34;1-15-13-21(19-7-3-5-9-23(19)29)27-25-17(15)11-12-18-16(2)14-22(28-26(18)25)20-8-4-6-10-24(20)30;27-21-7-3-1-5-17(21)19-13-11-15-9-10-16-12-14-20(26-24(16)23(15)25-19)18-6-2-4-8-22(18)28;1-15-11-13-19(25-23(15)17-7-3-5-9-21(17)27)20-14-12-16(2)24(26-20)18-8-4-6-10-22(18)28;;;;;;/h1-30,51-52H;1-22,39-40H;1-18,33-34H;3-14,29-30H,1-2H3;1-14,27-28H;3-14,27-28H,1-2H3;;;;;; |
| InChIKey | DBPKQFKZIPGLRC-UHFFFAOYSA-N |
| XLogP | 45.42 |
| TPSA | 397.44 Ų |
| H-Bond Donors | 12 |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 218 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3921.66 |
| LogP ≤ 5 | 45.42 |
| H-Bond Donors ≤ 5 | 12 |
| H-Bond Acceptors ≤ 10 | 24 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
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