2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate

C125H83F4N18O5Pt5S2- — CID 157174174

IUPAC2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate
SMILESFc1c[c-]c(-c2cccc(N(c3ccccc3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.Oc1ccccc1-c1cn(-c2ccccc2)c(-c2nc(-c3ccccc3O)cn2-c2ccccc2)n1.[CH2-]C(=O)c1cccc2c1nc(-c1nc3c(C(=O)O)cccc3n1C)n2C.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[S-]c1ccccc1-c1ccnc(-c2nccc(-c3ccccc3[S-])n2)n1.[c-]1ccccc1-c1cccc(N(c2ccccc2)c2cccc(-c3[c-]cccc3)n2)n1
InChIInChI=1S/C30H22N4O2.C28H15F4N3.C28H19N3.C20H14N4S2.C19H15N4O3.5Pt/c35-27-17-9-7-15-23(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;1-4-12-22(13-5-1)25-18-10-20-27(29-25)31(24-16-8-3-9-17-24)28-21-11-19-26(30-28)23-14-6-2-7-15-23;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;1-10(24)11-6-4-8-13-15(11)20-17(22(13)2)18-21-16-12(19(25)26)7-5-9-14(16)23(18)3;;;;;/h1-20,35-36H;1-13,16-17H;1-12,14,16-21H;1-12,25-26H;4-9H,1H2,2-3H3,(H,25,26);;;;;/q;2*-2;;-1;;;3*+2/p-2
InChIKeyUCNRGIAMCAWTPK-UHFFFAOYSA-L
MW3032.68 g/mol
LogP27.70
Rot. Bonds21

About 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate

2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate (PubChem CID 157174174) has the molecular formula C125H83F4N18O5Pt5S2- and a molecular weight of 3032.68 g/mol. Its IUPAC name is 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate.

Molecular Properties

Compound Name2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate
PubChem CID157174174
Molecular FormulaC125H83F4N18O5Pt5S2-
Molecular Weight3032.68 g/mol
Exact Mass3030.44
IUPAC Name2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate
SMILESFc1c[c-]c(-c2cccc(N(c3ccccc3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.Oc1ccccc1-c1cn(-c2ccccc2)c(-c2nc(-c3ccccc3O)cn2-c2ccccc2)n1.[CH2-]C(=O)c1cccc2c1nc(-c1nc3c(C(=O)O)cccc3n1C)n2C.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[S-]c1ccccc1-c1ccnc(-c2nccc(-c3ccccc3[S-])n2)n1.[c-]1ccccc1-c1cccc(N(c2ccccc2)c2cccc(-c3[c-]cccc3)n2)n1
InChIInChI=1S/C30H22N4O2.C28H15F4N3.C28H19N3.C20H14N4S2.C19H15N4O3.5Pt/c35-27-17-9-7-15-23(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;1-4-12-22(13-5-1)25-18-10-20-27(29-25)31(24-16-8-3-9-17-24)28-21-11-19-26(30-28)23-14-6-2-7-15-23;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;1-10(24)11-6-4-8-13-15(11)20-17(22(13)2)18-21-16-12(19(25)26)7-5-9-14(16)23(18)3;;;;;/h1-20,35-36H;1-13,16-17H;1-12,14,16-21H;1-12,25-26H;4-9H,1H2,2-3H3,(H,25,26);;;;;/q;2*-2;;-1;;;3*+2/p-2
InChIKeyUCNRGIAMCAWTPK-UHFFFAOYSA-L
XLogP27.70
TPSA275.71 Ų
H-Bond Donors3
H-Bond Acceptors24
Rotatable Bonds21
Heavy Atoms159
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003032.68
LogP ≤ 527.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?
The IUPAC name of 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate (CID 157174174) is 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate.
What is the SMILES notation for 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?
The canonical SMILES for 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate is Fc1c[c-]c(-c2cccc(N(c3ccccc3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.Oc1ccccc1-c1cn(-c2ccccc2)c(-c2nc(-c3ccccc3O)cn2-c2ccccc2)n1.[CH2-]C(=O)c1cccc2c1nc(-c1nc3c(C(=O)O)cccc3n1C)n2C.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[S-]c1ccccc1-c1ccnc(-c2nccc(-c3ccccc3[S-])n2)n1.[c-]1ccccc1-c1cccc(N(c2ccccc2)c2cccc(-c3[c-]cccc3)n2)n1.
What is the InChIKey of 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?
The InChIKey is UCNRGIAMCAWTPK-UHFFFAOYSA-L. The full InChI is InChI=1S/C30H22N4O2.C28H15F4N3.C28H19N3.C20H14N4S2.C19H15N4O3.5Pt/c35-27-17-9-7-15-23(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;1-4-12-22(13-5-1)25-18-10-20-27(29-25)31(24-16-8-3-9-17-24)28-21-11-19-26(30-28)23-14-6-2-7-15-23;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;1-10(24)11-6-4-8-13-15(11)20-17(22(13)2)18-21-16-12(19(25)26)7-5-9-14(16)23(18)3;;;;;/h1-20,35-36H;1-13,16-17H;1-12,14,16-21H;1-12,25-26H;4-9H,1H2,2-3H3,(H,25,26);;;;;/q;2*-2;;-1;;;3*+2/p-2.
What are the key properties of 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate?
2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate has a molecular weight of 3032.68 g/mol, XLogP of 27.70, 21 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetyl-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;N-phenyl-6-phenyl-N-(6-phenyl-2-pyridinyl)pyridin-2-amine;platinum;tris(platinum(2+));2-[2-[4-(2-sulfidophenyl)pyrimidin-2-yl]pyrimidin-4-yl]benzenethiolate is sourced from PubChem (CID 157174174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).