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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine

C169H114F8N14O3Pt6 — CID 157129975

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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine (PubChem CID 157129975) has the molecular formula C169H114F8N14O3Pt6 and a molecular weight of 3711.32 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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine
• PubChem CID: 157129975
• Molecular Formula: C169H114F8N14O3Pt6
• Molecular Weight: 3711.32 g/mol
• Exact Mass: 3708.70
• 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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine
• SMILES: CN(C)c1ccnc(-c2[c-]c(Cc3[c-]c(-c4cc(N(C)C)ccn4)c(F)cc3F)c(F)cc2F)c1.COc1cc(Cc2ccccn2)[c-]c(-c2[c-]c(Cc3ccccn3)cc(OC)c2)c1.Fc1cc(F)c(-c2ccccn2)[c-]c1Cc1[c-]c(-c2ccccn2)c(F)cc1F.O=C(c1[c-]c(-c2nccc3ccccc23)ccc1)c1[c-]c(-c2nccc3ccccc23)ccc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2cc3ccccc3cn2)cc2ccccc2c1Cc1[c-]c(-c2cc3ccccc3cn2)cc2ccccc12.[c-]1c(Cc2[c-]c(-c3ccccn3)ccc2)cccc1-c1ccccn1
• InChI: InChI=1S/C39H24N2.C31H18N2O.C27H22F4N4.C26H22N2O2.C23H12F4N2.C23H16N2.6Pt/c1-3-13-30-24-40-38(22-26(30)9-1)34-17-28-11-5-7-15-36(28)32(20-34)19-33-21-35(18-29-12-6-8-16-37(29)33)39-23-27-10-2-4-14-31(27)25-41-39;34-31(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;1-34(2)18-5-7-32-26(12-18)20-10-16(22(28)14-24(20)30)9-17-11-21(25(31)15-23(17)29)27-13-19(35(3)4)6-8-33-27;1-29-25-15-19(13-23-7-3-5-9-27-23)11-21(17-25)22-12-20(16-26(18-22)30-2)14-24-8-4-6-10-28-24;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;1-3-13-24-22(11-1)20-9-5-7-18(16-20)15-19-8-6-10-21(17-19)23-12-2-4-14-25-23;;;;;;/h1-18,22-25H,19H2;1-18H;5-8,12-15H,9H2,1-4H3;3-10,15-18H,13-14H2,1-2H3;1-8,12-13H,9H2;1-14H,15H2;;;;;;/q6*-2;6*+2
• InChIKey: BQBXVIWRQVWSEK-UHFFFAOYSA-N
• XLogP: 37.74
• TPSA: 196.69 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 29
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3711.32
LogP ≤ 5	37.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', '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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine (CID 157129975) 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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine is CN(C)c1ccnc(-c2[c-]c(Cc3[c-]c(-c4cc(N(C)C)ccn4)c(F)cc3F)c(F)cc2F)c1.COc1cc(Cc2ccccn2)[c-]c(-c2[c-]c(Cc3ccccn3)cc(OC)c2)c1.Fc1cc(F)c(-c2ccccn2)[c-]c1Cc1[c-]c(-c2ccccn2)c(F)cc1F.O=C(c1[c-]c(-c2nccc3ccccc23)ccc1)c1[c-]c(-c2nccc3ccccc23)ccc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2cc3ccccc3cn2)cc2ccccc2c1Cc1[c-]c(-c2cc3ccccc3cn2)cc2ccccc12.[c-]1c(Cc2[c-]c(-c3ccccn3)ccc2)cccc1-c1ccccn1.

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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine?

The InChIKey is BQBXVIWRQVWSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H24N2.C31H18N2O.C27H22F4N4.C26H22N2O2.C23H12F4N2.C23H16N2.6Pt/c1-3-13-30-24-40-38(22-26(30)9-1)34-17-28-11-5-7-15-36(28)32(20-34)19-33-21-35(18-29-12-6-8-16-37(29)33)39-23-27-10-2-4-14-31(27)25-41-39;34-31(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;1-34(2)18-5-7-32-26(12-18)20-10-16(22(28)14-24(20)30)9-17-11-21(25(31)15-23(17)29)27-13-19(35(3)4)6-8-33-27;1-29-25-15-19(13-23-7-3-5-9-27-23)11-21(17-25)22-12-20(16-26(18-22)30-2)14-24-8-4-6-10-28-24;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;1-3-13-24-22(11-1)20-9-5-7-18(16-20)15-19-8-6-10-21(17-19)23-12-2-4-14-25-23;;;;;;/h1-18,22-25H,19H2;1-18H;5-8,12-15H,9H2,1-4H3;3-10,15-18H,13-14H2,1-2H3;1-8,12-13H,9H2;1-14H,15H2;;;;;;/q6*-2;6*+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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine has a molecular weight of 3711.32 g/mol, XLogP of 37.74, 29 rotatable bonds, 0 hydrogen bond donors, and 17 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;2-[5-[[5-[4-(dimethylamino)-2-pyridinyl]-2,4-difluorobenzene-6-id-1-yl]methyl]-2,4-difluorobenzene-6-id-1-yl]-N,N-dimethylpyridin-4-amine;3-[4-[(3-isoquinolin-3-yl-2H-naphthalen-2-id-1-yl)methyl]-3H-naphthalen-3-id-2-yl]isoquinoline;2-[[3-methoxy-5-[3-methoxy-5-(pyridin-2-ylmethyl)benzene-6-id-1-yl]benzene-6-id-1-yl]methyl]pyridine;hexakis(platinum(2+));2-[3-[(3-pyridin-2-ylbenzene-2-id-1-yl)methyl]benzene-2-id-1-yl]pyridine is sourced from PubChem (CID 157129975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).