4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate

C64H50I3N16O6VY2 — CID 157389966

IUPAC4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate
SMILESC.I[V](I)I.N#Cc1ccc2[nH]c(-c3ccccc3)nc2n1.O.O=C(O)c1ccc2[nH]c(-c3ccccc3)nc2n1.O=C(O)c1ccc2[nH]c(-c3ccccc3)nc2n1.On1cccc2nc(-c3ccccc3)nc1-2.[Y].[Y].c1ccc(-c2nc3ncccc3[nH]2)cc1
InChIInChI=1S/C13H8N4.2C13H9N3O2.C12H9N3O.C12H9N3.CH4.3HI.H2O.V.2Y/c14-8-10-6-7-11-13(15-10)17-12(16-11)9-4-2-1-3-5-9;2*17-13(18)10-7-6-9-12(15-10)16-11(14-9)8-4-2-1-3-5-8;16-15-8-4-7-10-12(15)14-11(13-10)9-5-2-1-3-6-9;1-2-5-9(6-3-1)11-14-10-7-4-8-13-12(10)15-11;;;;;;;;/h1-7H,(H,15,16,17);2*1-7H,(H,17,18)(H,14,15,16);1-8,16H;1-8H,(H,13,14,15);1H4;3*1H;1H2;;;/q;;;;;;;;;;+3;;/p-3
InChIKeyKPCXIRHNLAAMMF-UHFFFAOYSA-K
MW1748.68 g/mol
LogP14.52
Rot. Bonds7

About 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate

4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate (PubChem CID 157389966) has the molecular formula C64H50I3N16O6VY2 and a molecular weight of 1748.68 g/mol. Its IUPAC name is 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate.

Molecular Properties

Compound Name4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate
PubChem CID157389966
Molecular FormulaC64H50I3N16O6VY2
Molecular Weight1748.68 g/mol
Exact Mass1747.88
IUPAC Name4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate
SMILESC.I[V](I)I.N#Cc1ccc2[nH]c(-c3ccccc3)nc2n1.O.O=C(O)c1ccc2[nH]c(-c3ccccc3)nc2n1.O=C(O)c1ccc2[nH]c(-c3ccccc3)nc2n1.On1cccc2nc(-c3ccccc3)nc1-2.[Y].[Y].c1ccc(-c2nc3ncccc3[nH]2)cc1
InChIInChI=1S/C13H8N4.2C13H9N3O2.C12H9N3O.C12H9N3.CH4.3HI.H2O.V.2Y/c14-8-10-6-7-11-13(15-10)17-12(16-11)9-4-2-1-3-5-9;2*17-13(18)10-7-6-9-12(15-10)16-11(14-9)8-4-2-1-3-5-8;16-15-8-4-7-10-12(15)14-11(13-10)9-5-2-1-3-6-9;1-2-5-9(6-3-1)11-14-10-7-4-8-13-12(10)15-11;;;;;;;;/h1-7H,(H,15,16,17);2*1-7H,(H,17,18)(H,14,15,16);1-8,16H;1-8H,(H,13,14,15);1H4;3*1H;1H2;;;/q;;;;;;;;;;+3;;/p-3
InChIKeyKPCXIRHNLAAMMF-UHFFFAOYSA-K
XLogP14.52
TPSA347.11 Ų
H-Bond Donors7
H-Bond Acceptors15
Rotatable Bonds7
Heavy Atoms92
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001748.68
LogP ≤ 514.52
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

Analyze 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzene-1,2-diamine;bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]-1H-benzimidazole);tris(1-methyl-2-[6-(1-methylbenzimidazol-2-yl)-2-pyridinyl]benzimidazole);2-phenylpyridine;pyridine-2,6-dicarboxylic acid;bis(trichloroiridium);tetrahydrate
CID 158082723
4-(aminomethyl)benzamide;4-[[(6-bromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]benzamide;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-methyl-1H-imidazole;4-[[[6-(2-methylimidazol-1-yl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzamide;4-[[[6-(2-methylimidazol-1-yl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzamide;pyridine-2-carboxylic acid;hydrochloride
CID 158561305
N-[2-(4-aminophenyl)-3H-imidazo[4,5-c]pyridin-6-yl]cyclohexanecarboxamide;bis(N-[4-[6-(cyclohexanecarbonylamino)-3H-imidazo[4,5-c]pyridin-2-yl]phenyl]cyclohexanecarboxamide);methanol;4-nitrobenzoic acid;2-(4-nitrophenyl)-3H-imidazo[4,5-c]pyridin-6-amine;N-[2-(4-nitrophenyl)-3H-imidazo[4,5-c]pyridin-6-yl]cyclohexanecarboxamide;pyridine-2,4,5-triamine
CID 161047287

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate?
The IUPAC name of 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate (CID 157389966) is 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate.
What is the SMILES notation for 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate?
The canonical SMILES for 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate is C.I[V](I)I.N#Cc1ccc2[nH]c(-c3ccccc3)nc2n1.O.O=C(O)c1ccc2[nH]c(-c3ccccc3)nc2n1.O=C(O)c1ccc2[nH]c(-c3ccccc3)nc2n1.On1cccc2nc(-c3ccccc3)nc1-2.[Y].[Y].c1ccc(-c2nc3ncccc3[nH]2)cc1.
What is the InChIKey of 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate?
The InChIKey is KPCXIRHNLAAMMF-UHFFFAOYSA-K. The full InChI is InChI=1S/C13H8N4.2C13H9N3O2.C12H9N3O.C12H9N3.CH4.3HI.H2O.V.2Y/c14-8-10-6-7-11-13(15-10)17-12(16-11)9-4-2-1-3-5-9;2*17-13(18)10-7-6-9-12(15-10)16-11(14-9)8-4-2-1-3-5-8;16-15-8-4-7-10-12(15)14-11(13-10)9-5-2-1-3-6-9;1-2-5-9(6-3-1)11-14-10-7-4-8-13-12(10)15-11;;;;;;;;/h1-7H,(H,15,16,17);2*1-7H,(H,17,18)(H,14,15,16);1-8,16H;1-8H,(H,13,14,15);1H4;3*1H;1H2;;;/q;;;;;;;;;;+3;;/p-3.
What are the key properties of 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate?
4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate has a molecular weight of 1748.68 g/mol, XLogP of 14.52, 7 rotatable bonds, 7 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-phenylimidazo[4,5-b]pyridine;methane;2-phenyl-1H-imidazo[4,5-b]pyridine;2-phenyl-1H-imidazo[4,5-b]pyridine-5-carbonitrile;bis(2-phenyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid);triiodovanadium;bis(yttrium);hydrate is sourced from PubChem (CID 157389966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).