3-[6-[1-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]cyclopentyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-diphenylmethyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(4-phenylbenzene-6-id-1-yl)-6-[2-[6-(4-phenylbenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;platinum;tetrakis(platinum(2+))
C136H90F15N18O2Pt5- — CID 158082063
Data last refreshed: (MolForge compound catalog, from PubChem)
About 3-[6-[1-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]cyclopentyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-diphenylmethyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(4-phenylbenzene-6-id-1-yl)-6-[2-[6-(4-phenylbenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;platinum;tetrakis(platinum(2+))
3-[6-[1-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]cyclopentyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-diphenylmethyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(4-phenylbenzene-6-id-1-yl)-6-[2-[6-(4-phenylbenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;platinum;tetrakis(platinum(2+)) (PubChem CID 158082063) has the molecular formula C136H90F15N18O2Pt5- and a molecular weight of 3268.70 g/mol. Its IUPAC name is 3-[6-[1-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]cyclopentyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-diphenylmethyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(4-phenylbenzene-6-id-1-yl)-6-[2-[6-(4-phenylbenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;platinum;tetrakis(platinum(2+)).
Molecular Properties
| Compound Name | 3-[6-[1-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]cyclopentyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-diphenylmethyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(4-phenylbenzene-6-id-1-yl)-6-[2-[6-(4-phenylbenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;platinum;tetrakis(platinum(2+)) |
|---|---|
| PubChem CID | 158082063 |
| Molecular Formula | C136H90F15N18O2Pt5- |
| Molecular Weight | 3268.70 g/mol |
| Exact Mass | 3266.55 |
| IUPAC Name | 3-[6-[1-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]cyclopentyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-diphenylmethyl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(4-phenylbenzene-6-id-1-yl)-6-[2-[6-(4-phenylbenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;platinum;tetrakis(platinum(2+)) |
| SMILES | CC(C)(c1cccc(-c2[c-]cc(-c3ccccc3)cc2)n1)c1cccc(-c2[c-]cc(-c3ccccc3)cc2)n1.CC(C)(c1cccc(-c2[c-]cc(F)nc2F)n1)c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1.CC(C)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.Fc1c[c-]c(-c2cccc(C(c3ccccc3)(c3ccccc3)c3cccc(-c4[c-]cc(F)nc4F)n3)n2)c(F)n1.Fc1c[c-]c(-c2cccc(C3(c4cccc(-c5[c-]cc(F)nc5F)n4)CCCC3)n2)c(F)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt] |
| InChI | InChI=1S/C37H28N2.C33H18F4N4.C25H16F4N4.C22H14F5N5.C19H14F2N3O2.5Pt/c1-37(2,35-17-9-15-33(38-35)31-23-19-29(20-24-31)27-11-5-3-6-12-27)36-18-10-16-34(39-36)32-25-21-30(22-26-32)28-13-7-4-8-14-28;34-29-19-17-23(31(36)40-29)25-13-7-15-27(38-25)33(21-9-3-1-4-10-21,22-11-5-2-6-12-22)28-16-8-14-26(39-28)24-18-20-30(35)41-32(24)37;26-21-11-9-15(23(28)32-21)17-5-3-7-19(30-17)25(13-1-2-14-25)20-8-4-6-18(31-20)16-10-12-22(27)33-24(16)29;1-21(2,15-6-3-5-14(28-15)13-9-10-18(23)30-20(13)24)16-7-4-8-19(29-16)32-12-11-17(31-32)22(25,26)27;1-19(2,15-8-4-6-13(23-15)18(25)26)14-7-3-5-12(22-14)11-9-10-16(20)24-17(11)21;;;;;/h3-23,25H,1-2H3;1-16,19-20H;3-8,11-12H,1-2,13-14H2;3-8,10-11H,1-2H3;3-8,10H,1-2H3,(H,25,26);;;;;/q4*-2;-1;;4*+2 |
| InChIKey | YDYDNHIUTSIODW-UHFFFAOYSA-N |
| XLogP | 30.40 |
| TPSA | 261.36 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 19 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 176 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3268.70 |
| LogP ≤ 5 | 30.40 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 19 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
|---|
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Sources
- PubChem CID 158082063 — identifiers, structure, computed properties (public domain)
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