2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate

C162H112F4N22O8Pt6S2 — CID 157444680

About 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate

2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate (PubChem CID 157444680) has the molecular formula C162H112F4N22O8Pt6S2 and a molecular weight of 3805.42 g/mol. Its IUPAC name is 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate.

Molecular Properties

• Compound Name: 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate
• PubChem CID: 157444680
• Molecular Formula: C162H112F4N22O8Pt6S2
• Molecular Weight: 3805.42 g/mol
• Exact Mass: 3802.63
• IUPAC Name: 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate
• SMILES: C[N-]c1ccccc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4ccccc4[N-]C)nc3c2n1.Cn1c(-c2nc3c(C(=O)O)cccc3n2C)nc2c(C(=O)O)cccc21.Fc1c[c-]c(-c2cccc(N(c3ccccc3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.Oc1ccccc1-c1cccc(N(c2ccccc2)c2cccc(-c3ccccc3O)n2)n1.Oc1ccccc1-c1cn(-c2ccccc2)c(-c2nc(-c3ccccc3O)cn2-c2ccccc2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[Pt].[S-]c1ccccc1-c1ccnc(-c2nccc(-c3ccccc3[S-])n2)n1
• InChI: InChI=1S/C38H28N4.C30H22N4O2.C28H15F4N3.C28H21N3O2.C20H14N4S2.C18H14N4O4.6Pt/c1-39-33-19-11-9-17-29(33)35-23-31(25-13-5-3-6-14-25)27-21-22-28-32(26-15-7-4-8-16-26)24-36(42-38(28)37(27)41-35)30-18-10-12-20-34(30)40-2;35-27-17-9-7-15-23(27)25-19-33(21-11-3-1-4-12-21)29(31-25)30-32-26(24-16-8-10-18-28(24)36)20-34(30)22-13-5-2-6-14-22;29-18-12-14-21(23(31)16-18)25-8-4-10-27(33-25)35(20-6-2-1-3-7-20)28-11-5-9-26(34-28)22-15-13-19(30)17-24(22)32;32-25-16-6-4-12-21(25)23-14-8-18-27(29-23)31(20-10-2-1-3-11-20)28-19-9-15-24(30-28)22-13-5-7-17-26(22)33;25-17-7-3-1-5-13(17)15-9-11-21-19(23-15)20-22-12-10-16(24-20)14-6-2-4-8-18(14)26;1-21-11-7-3-5-9(17(23)24)13(11)19-15(21)16-20-14-10(18(25)26)6-4-8-12(14)22(16)2;;;;;;/h3-24H,1-2H3;1-20,35-36H;1-13,16-17H;1-19,32-33H;1-12,25-26H;3-8H,1-2H3,(H,23,24)(H,25,26);;;;;;/q-2;;-2;;;;;;;3*+2/p-2
• InChIKey: USWVPYLDZODPEP-UHFFFAOYSA-L
• XLogP: 37.91
• TPSA: 390.38 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 28
• Rotatable Bonds: 27
• Heavy Atoms: 204
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3805.42
LogP ≤ 5	37.91
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?

The IUPAC name of 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate (CID 157444680) is 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate.

What is the SMILES notation for 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?

The canonical SMILES for 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate is C[N-]c1ccccc1-c1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(-c4ccccc4[N-]C)nc3c2n1.Cn1c(-c2nc3c(C(=O)O)cccc3n2C)nc2c(C(=O)O)cccc21.Fc1c[c-]c(-c2cccc(N(c3ccccc3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.Oc1ccccc1-c1cccc(N(c2ccccc2)c2cccc(-c3ccccc3O)n2)n1.Oc1ccccc1-c1cn(-c2ccccc2)c(-c2nc(-c3ccccc3O)cn2-c2ccccc2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[Pt].[S-]c1ccccc1-c1ccnc(-c2nccc(-c3ccccc3[S-])n2)n1.

What is the InChIKey of 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?

The InChIKey is USWVPYLDZODPEP-UHFFFAOYSA-L. The full InChI is InChI=1S/C38H28N4.C30H22N4O2.C28H15F4N3.C28H21N3O2.C20H14N4S2.C18H14N4O4.6Pt/c1-39-33-19-11-9-17-29(33)35-23-31(25-13-5-3-6-14-25)27-21-22-28-32(26-15-7-4-8-16-26)24-36(42-38(28)37(27)41-35)30-18-10-12-20-34(30)40-2;35-27-17-9-7-15-23(27)25-19-33(21-11-3-1-4-12-21)29(31-25)30-32-26(24-16-8-10-18-28(24)36)20-34(30)22-13-5-2-6-14-22;29-18-12-14-21(23(31)16-18)25-8-4-10-27(33-25)35(20-6-2-1-3-7-20)28-11-5-9-26(34-28)22-15-13-19(30)17-24(22)32;32-25-16-6-4-12-21(25)23-14-8-18-27(29-23)31(20-10-2-1-3-11-20)28-19-9-15-24(30-28)22-13-5-7-17-26(22)33;25-17-7-3-1-5-13(17)15-9-11-21-19(23-15)20-22-12-10-16(24-20)14-6-2-4-8-18(14)26;1-21-11-7-3-5-9(17(23)24)13(11)19-15(21)16-20-14-10(18(25)26)6-4-8-12(14)22(16)2;;;;;;/h3-24H,1-2H3;1-20,35-36H;1-13,16-17H;1-19,32-33H;1-12,25-26H;3-8H,1-2H3,(H,23,24)(H,25,26);;;;;;/q-2;;-2;;;;;;;3*+2/p-2.

What are the key properties of 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?

2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate has a molecular weight of 3805.42 g/mol, XLogP of 37.91, 27 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-carboxy-1-methylbenzimidazol-2-yl)-1-methylbenzimidazole-4-carboxylic acid;6-(2,4-difluorobenzene-6-id-1-yl)-N-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-[2-[4-(2-hydroxyphenyl)-1-phenylimidazol-2-yl]-1-phenylimidazol-4-yl]phenol;2-[6-(N-[6-(2-hydroxyphenyl)-2-pyridinyl]anilino)-2-pyridinyl]phenol;methyl-[2-[9-(2-methylazanidylphenyl)-4,7-diphenyl-1,10-phenanthrolin-2-yl]phenyl]azanide;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate is sourced from PubChem (CID 157444680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).