2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine

C67H53N19O3Pt6S-6 — CID 158485291

IUPAC2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine
SMILESCC1(C)N=C(c2ccccn2)[N-]C1(C)C.Cn1ccnc1-c1nc2ccccc2[n-]1.O=C([N-]C(=O)c1ccccn1)c1ccccc1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].c1ccc(-c2nc3cccnc3[n-]2)nc1.c1ccc2[n-]c(-c3ncco3)nc2c1.c1ccc2[n-]c(-c3nccs3)nc2c1
InChIInChI=1S/C13H10N2O2.C12H16N3.C11H9N4.C11H7N4.C10H6N3O.C10H6N3S.6Pt/c16-12(10-6-2-1-3-7-10)15-13(17)11-8-4-5-9-14-11;1-11(2)12(3,4)15-10(14-11)9-7-5-6-8-13-9;1-15-7-6-12-11(15)10-13-8-4-2-3-5-9(8)14-10;1-2-6-12-8(4-1)11-14-9-5-3-7-13-10(9)15-11;2*1-2-4-8-7(3-1)12-9(13-8)10-11-5-6-14-10;;;;;;/h1-9H,(H,15,16,17);5-8H,1-4H3;2-7H,1H3;1-7H;2*1-6H;;;;;;/q;5*-1;;;;;;/p-1
InChIKeyBSLOGOIFSYEZHM-UHFFFAOYSA-M
MW2374.83 g/mol
LogP12.60
Rot. Bonds7

About 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine

2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine (PubChem CID 158485291) has the molecular formula C67H53N19O3Pt6S-6 and a molecular weight of 2374.83 g/mol. Its IUPAC name is 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine.

Molecular Properties

Compound Name2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine
PubChem CID158485291
Molecular FormulaC67H53N19O3Pt6S-6
Molecular Weight2374.83 g/mol
Exact Mass2373.22
IUPAC Name2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine
SMILESCC1(C)N=C(c2ccccn2)[N-]C1(C)C.Cn1ccnc1-c1nc2ccccc2[n-]1.O=C([N-]C(=O)c1ccccn1)c1ccccc1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].c1ccc(-c2nc3cccnc3[n-]2)nc1.c1ccc2[n-]c(-c3ncco3)nc2c1.c1ccc2[n-]c(-c3nccs3)nc2c1
InChIInChI=1S/C13H10N2O2.C12H16N3.C11H9N4.C11H7N4.C10H6N3O.C10H6N3S.6Pt/c16-12(10-6-2-1-3-7-10)15-13(17)11-8-4-5-9-14-11;1-11(2)12(3,4)15-10(14-11)9-7-5-6-8-13-9;1-15-7-6-12-11(15)10-13-8-4-2-3-5-9(8)14-10;1-2-6-12-8(4-1)11-14-9-5-3-7-13-10(9)15-11;2*1-2-4-8-7(3-1)12-9(13-8)10-11-5-6-14-10;;;;;;/h1-9H,(H,15,16,17);5-8H,1-4H3;2-7H,1H3;1-7H;2*1-6H;;;;;;/q;5*-1;;;;;;/p-1
InChIKeyBSLOGOIFSYEZHM-UHFFFAOYSA-M
XLogP12.60
TPSA290.96 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds7
Heavy Atoms96
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002374.83
LogP ≤ 512.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine?
The IUPAC name of 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine (CID 158485291) is 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine.
What is the SMILES notation for 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine?
The canonical SMILES for 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine is CC1(C)N=C(c2ccccn2)[N-]C1(C)C.Cn1ccnc1-c1nc2ccccc2[n-]1.O=C([N-]C(=O)c1ccccn1)c1ccccc1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].c1ccc(-c2nc3cccnc3[n-]2)nc1.c1ccc2[n-]c(-c3ncco3)nc2c1.c1ccc2[n-]c(-c3nccs3)nc2c1.
What is the InChIKey of 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine?
The InChIKey is BSLOGOIFSYEZHM-UHFFFAOYSA-M. The full InChI is InChI=1S/C13H10N2O2.C12H16N3.C11H9N4.C11H7N4.C10H6N3O.C10H6N3S.6Pt/c16-12(10-6-2-1-3-7-10)15-13(17)11-8-4-5-9-14-11;1-11(2)12(3,4)15-10(14-11)9-7-5-6-8-13-9;1-15-7-6-12-11(15)10-13-8-4-2-3-5-9(8)14-10;1-2-6-12-8(4-1)11-14-9-5-3-7-13-10(9)15-11;2*1-2-4-8-7(3-1)12-9(13-8)10-11-5-6-14-10;;;;;;/h1-9H,(H,15,16,17);5-8H,1-4H3;2-7H,1H3;1-7H;2*1-6H;;;;;;/q;5*-1;;;;;;/p-1.
What are the key properties of 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine?
2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine has a molecular weight of 2374.83 g/mol, XLogP of 12.60, 7 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-id-2-yl)-1,3-oxazole;2-(benzimidazol-1-id-2-yl)-1,3-thiazole;benzoyl(pyridine-2-carbonyl)azanide;2-(1-methylimidazol-2-yl)benzimidazol-1-ide;platinum;2-pyridin-2-ylimidazo[4,5-b]pyridin-3-ide;2-(4,4,5,5-tetramethylimidazol-3-id-2-yl)pyridine is sourced from PubChem (CID 158485291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).