2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine

C114H72BrI4N11O3Pt5S2 — CID 157104154

IUPAC2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine
SMILESBr[Pt+].COC(=O)c1ccc2ccc3ccc(-c4[c-]c5ccccc5o4)nc3c2n1.I[Pt+].I[Pt+].I[Pt+].I[Pt+].[c-]1c(-c2cccc(-c3cccc(-c4cc5ccccc5s4)n3)n2)sc2ccccc12.[c-]1cccc2c1-c1nc(-c3nc4ccccc4[nH]3)ccc1CC2.[c-]1ccccc1-c1ccc2ccc3ccc(-c4ccccc4)nc3c2n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3ccccc3)n2)n1
InChIInChI=1S/C26H15N2S2.C24H15N2.C22H13N2O3.C22H15N2.C20H14N3.BrH.4HI.5Pt/c1-3-13-23-17(7-1)15-25(29-23)21-11-5-9-19(27-21)20-10-6-12-22(28-20)26-16-18-8-2-4-14-24(18)30-26;1-3-7-17(8-4-1)21-15-13-19-11-12-20-14-16-22(18-9-5-2-6-10-18)26-24(20)23(19)25-21;1-26-22(25)17-11-9-14-7-6-13-8-10-16(23-20(13)21(14)24-17)19-12-15-4-2-3-5-18(15)27-19;1-3-9-17(10-4-1)19-13-7-15-21(23-19)22-16-8-14-20(24-22)18-11-5-2-6-12-18;1-2-6-15-13(5-1)9-10-14-11-12-18(21-19(14)15)20-22-16-7-3-4-8-17(16)23-20;;;;;;;;;;/h1-15H;1-9,11-16H;2-11H,1H3;1-11,13-16H;1-5,7-8,11-12H,9-10H2,(H,22,23);5*1H;;;;;/q5*-1;;;;;;5*+2/p-5
InChIKeyLKHCGJNWIPSMLF-UHFFFAOYSA-I
MW3270.95 g/mol
LogP32.25
Rot. Bonds11

About 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine

2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine (PubChem CID 157104154) has the molecular formula C114H72BrI4N11O3Pt5S2 and a molecular weight of 3270.95 g/mol. Its IUPAC name is 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Name2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine
PubChem CID157104154
Molecular FormulaC114H72BrI4N11O3Pt5S2
Molecular Weight3270.95 g/mol
Exact Mass3267.89
IUPAC Name2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine
SMILESBr[Pt+].COC(=O)c1ccc2ccc3ccc(-c4[c-]c5ccccc5o4)nc3c2n1.I[Pt+].I[Pt+].I[Pt+].I[Pt+].[c-]1c(-c2cccc(-c3cccc(-c4cc5ccccc5s4)n3)n2)sc2ccccc12.[c-]1cccc2c1-c1nc(-c3nc4ccccc4[nH]3)ccc1CC2.[c-]1ccccc1-c1ccc2ccc3ccc(-c4ccccc4)nc3c2n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3ccccc3)n2)n1
InChIInChI=1S/C26H15N2S2.C24H15N2.C22H13N2O3.C22H15N2.C20H14N3.BrH.4HI.5Pt/c1-3-13-23-17(7-1)15-25(29-23)21-11-5-9-19(27-21)20-10-6-12-22(28-20)26-16-18-8-2-4-14-24(18)30-26;1-3-7-17(8-4-1)21-15-13-19-11-12-20-14-16-22(18-9-5-2-6-10-18)26-24(20)23(19)25-21;1-26-22(25)17-11-9-14-7-6-13-8-10-16(23-20(13)21(14)24-17)19-12-15-4-2-3-5-18(15)27-19;1-3-9-17(10-4-1)19-13-7-15-21(23-19)22-16-8-14-20(24-22)18-11-5-2-6-12-18;1-2-6-15-13(5-1)9-10-14-11-12-18(21-19(14)15)20-22-16-7-3-4-8-17(16)23-20;;;;;;;;;;/h1-15H;1-9,11-16H;2-11H,1H3;1-11,13-16H;1-5,7-8,11-12H,9-10H2,(H,22,23);5*1H;;;;;/q5*-1;;;;;;5*+2/p-5
InChIKeyLKHCGJNWIPSMLF-UHFFFAOYSA-I
XLogP32.25
TPSA184.13 Ų
H-Bond Donors1
H-Bond Acceptors15
Rotatable Bonds11
Heavy Atoms140
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003270.95
LogP ≤ 532.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine with MolForge

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Related Compounds

2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;hexakis(chloroplatinum(1+));N,N-diphenyl-2-pyridin-2-yl-10H-1,7-phenanthrolin-10-id-8-amine;methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;6-[6-(4-methylsulfanylbenzene-6-id-1-yl)-2-pyridinyl]-N-phenylpyridine-2-carboxamide;2-(9-phenyl-10H-benzo[h]quinolin-10-id-2-yl)-1,3-benzothiazole;9-phenyl-2-phenyl-1,10-phenanthroline
CID 157090541

Frequently Asked Questions

What is the IUPAC name of 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine?
The IUPAC name of 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine (CID 157104154) is 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine.
What is the SMILES notation for 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine?
The canonical SMILES for 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine is Br[Pt+].COC(=O)c1ccc2ccc3ccc(-c4[c-]c5ccccc5o4)nc3c2n1.I[Pt+].I[Pt+].I[Pt+].I[Pt+].[c-]1c(-c2cccc(-c3cccc(-c4cc5ccccc5s4)n3)n2)sc2ccccc12.[c-]1cccc2c1-c1nc(-c3nc4ccccc4[nH]3)ccc1CC2.[c-]1ccccc1-c1ccc2ccc3ccc(-c4ccccc4)nc3c2n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3ccccc3)n2)n1.
What is the InChIKey of 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine?
The InChIKey is LKHCGJNWIPSMLF-UHFFFAOYSA-I. The full InChI is InChI=1S/C26H15N2S2.C24H15N2.C22H13N2O3.C22H15N2.C20H14N3.BrH.4HI.5Pt/c1-3-13-23-17(7-1)15-25(29-23)21-11-5-9-19(27-21)20-10-6-12-22(28-20)26-16-18-8-2-4-14-24(18)30-26;1-3-7-17(8-4-1)21-15-13-19-11-12-20-14-16-22(18-9-5-2-6-10-18)26-24(20)23(19)25-21;1-26-22(25)17-11-9-14-7-6-13-8-10-16(23-20(13)21(14)24-17)19-12-15-4-2-3-5-18(15)27-19;1-3-9-17(10-4-1)19-13-7-15-21(23-19)22-16-8-14-20(24-22)18-11-5-2-6-12-18;1-2-6-15-13(5-1)9-10-14-11-12-18(21-19(14)15)20-22-16-7-3-4-8-17(16)23-20;;;;;;;;;;/h1-15H;1-9,11-16H;2-11H,1H3;1-11,13-16H;1-5,7-8,11-12H,9-10H2,(H,22,23);5*1H;;;;;/q5*-1;;;;;;5*+2/p-5.
What are the key properties of 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine?
2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine has a molecular weight of 3270.95 g/mol, XLogP of 32.25, 11 rotatable bonds, 1 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-benzimidazol-2-yl)-6,10-dihydro-5H-benzo[h]quinolin-10-ide;2-(3H-1-benzothiophen-3-id-2-yl)-6-[6-(1-benzothiophen-2-yl)-2-pyridinyl]pyridine;bromoplatinum(1+);tetrakis(iodoplatinum(1+));methyl 9-(3H-1-benzofuran-3-id-2-yl)-1,10-phenanthroline-2-carboxylate;9-phenyl-2-phenyl-1,10-phenanthroline;2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine is sourced from PubChem (CID 157104154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).