bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine

C137H88F4N11O5Pt5- — CID 159334863

About bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine

bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine (PubChem CID 159334863) has the molecular formula C137H88F4N11O5Pt5- and a molecular weight of 3019.66 g/mol. Its IUPAC name is bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine.

Molecular Properties

• Compound Name: bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine
• PubChem CID: 159334863
• Molecular Formula: C137H88F4N11O5Pt5-
• Molecular Weight: 3019.66 g/mol
• Exact Mass: 3017.52
• IUPAC Name: bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine
• SMILES: CC(C)(c1[c-]c(-c2[c-]c(C(C)(C)c3ccccn3)ccc2)ccc1)c1ccccn1.Fc1cc(F)c(-c2ccccn2)[c-]c1Cc1[c-]c(-c2ccccn2)c(F)cc1F.O=C(c1[c-]c(-c2nccc3ccccc23)ccc1)c1[c-]c(-c2nccc3ccccc23)ccc1.O=C(c1[c-]c2c(cc1)ccc1ccc(C(=O)c3ccccn3)[c-]c12)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt].[c-]1c(Oc2nccc3ccccc23)cccc1-c1cccc(Oc2nccc3ccccc23)n1
• InChI: InChI=1S/C31H18N2O.C29H18N3O2.C28H26N2.C26H14N2O2.C23H12F4N2.5Pt/c34-31(25-11-5-9-23(19-25)29-27-13-3-1-7-21(27)15-17-32-29)26-12-6-10-24(20-26)30-28-14-4-2-8-22(28)16-18-33-30;1-3-11-24-20(7-1)15-17-30-28(24)33-23-10-5-9-22(19-23)26-13-6-14-27(32-26)34-29-25-12-4-2-8-21(25)16-18-31-29;1-27(2,25-15-5-7-17-29-25)23-13-9-11-21(19-23)22-12-10-14-24(20-22)28(3,4)26-16-6-8-18-30-26;29-25(23-5-1-3-13-27-23)19-11-9-17-7-8-18-10-12-20(16-22(18)21(17)15-19)26(30)24-6-2-4-14-28-24;24-18-12-20(26)16(22-5-1-3-7-28-22)10-14(18)9-15-11-17(21(27)13-19(15)25)23-6-2-4-8-29-23;;;;;/h2*1-18H;5-18H,1-4H3;1-14H;1-8,12-13H,9H2;;;;;/q-2;-1;3*-2;;4*+2
• InChIKey: GBJZGZUABZNQDI-UHFFFAOYSA-N
• XLogP: 30.97
• TPSA: 211.46 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 22
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3019.66
LogP ≤ 5	30.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine?

The IUPAC name of bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine (CID 159334863) is bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine.

What is the SMILES notation for bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine?

The canonical SMILES for bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine is CC(C)(c1[c-]c(-c2[c-]c(C(C)(C)c3ccccn3)ccc2)ccc1)c1ccccn1.Fc1cc(F)c(-c2ccccn2)[c-]c1Cc1[c-]c(-c2ccccn2)c(F)cc1F.O=C(c1[c-]c(-c2nccc3ccccc23)ccc1)c1[c-]c(-c2nccc3ccccc23)ccc1.O=C(c1[c-]c2c(cc1)ccc1ccc(C(=O)c3ccccn3)[c-]c12)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt].[c-]1c(Oc2nccc3ccccc23)cccc1-c1cccc(Oc2nccc3ccccc23)n1.

What is the InChIKey of bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine?

The InChIKey is GBJZGZUABZNQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H18N2O.C29H18N3O2.C28H26N2.C26H14N2O2.C23H12F4N2.5Pt/c34-31(25-11-5-9-23(19-25)29-27-13-3-1-7-21(27)15-17-32-29)26-12-6-10-24(20-26)30-28-14-4-2-8-22(28)16-18-33-30;1-3-11-24-20(7-1)15-17-30-28(24)33-23-10-5-9-22(19-23)26-13-6-14-27(32-26)34-29-25-12-4-2-8-21(25)16-18-31-29;1-27(2,25-15-5-7-17-29-25)23-13-9-11-21(19-23)22-12-10-14-24(20-22)28(3,4)26-16-6-8-18-30-26;29-25(23-5-1-3-13-27-23)19-11-9-17-7-8-18-10-12-20(16-22(18)21(17)15-19)26(30)24-6-2-4-14-28-24;24-18-12-20(26)16(22-5-1-3-7-28-22)10-14(18)9-15-11-17(21(27)13-19(15)25)23-6-2-4-8-29-23;;;;;/h2*1-18H;5-18H,1-4H3;1-14H;1-8,12-13H,9H2;;;;;/q-2;-1;3*-2;;4*+2.

What are the key properties of bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine?

bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine has a molecular weight of 3019.66 g/mol, XLogP of 30.97, 22 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for bis(3-isoquinolin-1-ylbenzene-2-id-1-yl)methanone;2-[5-[(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)methyl]-2,4-difluorobenzene-6-id-1-yl]pyridine;1-[[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-2-pyridinyl]oxy]isoquinoline;platinum;tetrakis(platinum(2+));[6-(pyridine-2-carbonyl)-4,5-dihydrophenanthrene-4,5-diid-3-yl]-pyridin-2-ylmethanone;2-[2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]benzene-2-id-1-yl]propan-2-yl]pyridine is sourced from PubChem (CID 159334863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).