potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide

C186H189BBrI4KN21NaO26P4PdSZn — CID 159583643

IUPACpotassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide
SMILESBrc1cnc2[nH]ccc2c1.C.C.C.C.C.C.C.CCO.CCOC(=O)c1cnc2[nH]cc(I)c2c1.CCOC(=O)c1cnc2[nH]ccc2c1.CCOC(=O)c1cnc2c(c1)c(-c1ccoc1)cn2C.CCOC(=O)c1cnc2c(c1)c(I)cn2C.COc1ccccc1N.COc1ccccc1NC(=O)c1cnc2[nH]cc(-c3ccoc3)c2c1.II.N#Cc1cnc2[nH]ccc2c1.O=C(O)c1cnc2[nH]cc(-c3ccoc3)c2c1.O=S(=O)(O)O.OB(O)c1ccoc1.[C-]#N.[C-]#N.[K+].[Na+].[OH-].[OH-].[Pd].[Zn+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H15N3O3.4C18H15P.C15H14N2O3.C12H8N2O3.C11H11IN2O2.C10H9IN2O2.C10H10N2O2.C8H5N3.C7H5BrN2.C7H9NO.C4H5BO3.C2H6O.2CN.7CH4.I2.K.Na.H2O4S.2H2O.Pd.Zn/c1-24-17-5-3-2-4-16(17)22-19(23)13-8-14-15(12-6-7-25-11-12)10-21-18(14)20-9-13;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-20-15(18)11-6-12-13(10-4-5-19-9-10)8-17(2)14(12)16-7-11;15-12(16)8-3-9-10(7-1-2-17-6-7)5-14-11(9)13-4-8;1-3-16-11(15)7-4-8-9(12)6-14(2)10(8)13-5-7;1-2-15-10(14)6-3-7-8(11)5-13-9(7)12-4-6;1-2-14-10(13)8-5-7-3-4-11-9(7)12-6-8;9-4-6-3-7-1-2-10-8(7)11-5-6;8-6-3-5-1-2-9-7(5)10-4-6;1-9-7-5-3-2-4-6(7)8;6-5(7)4-1-2-8-3-4;1-2-3;2*1-2;;;;;;;;1-2;;;1-5(2,3)4;;;;/h2-11H,1H3,(H,20,21)(H,22,23);4*1-15H;4-9H,3H2,1-2H3;1-6H,(H,13,14)(H,15,16);4-6H,3H2,1-2H3;3-5H,2H2,1H3,(H,12,13);3-6H,2H2,1H3,(H,11,12);1-3,5H,(H,10,11);1-4H,(H,9,10);2-5H,8H2,1H3;1-3,6-7H;3H,2H2,1H3;;;7*1H4;;;;(H2,1,2,3,4);2*1H2;;/q;;;;;;;;;;;;;;;2*-1;;;;;;;;;2*+1;;;;;+2/p-2
InChIKeyZOOLAFCSOYWRDI-UHFFFAOYSA-L
MW4122.87 g/mol
LogP33.24
Rot. Bonds29

About potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide

potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide (PubChem CID 159583643) has the molecular formula C186H189BBrI4KN21NaO26P4PdSZn and a molecular weight of 4122.87 g/mol. Its IUPAC name is potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide.

Molecular Properties

Compound Namepotassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide
PubChem CID159583643
Molecular FormulaC186H189BBrI4KN21NaO26P4PdSZn
Molecular Weight4122.87 g/mol
Exact Mass4117.61
IUPAC Namepotassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide
SMILESBrc1cnc2[nH]ccc2c1.C.C.C.C.C.C.C.CCO.CCOC(=O)c1cnc2[nH]cc(I)c2c1.CCOC(=O)c1cnc2[nH]ccc2c1.CCOC(=O)c1cnc2c(c1)c(-c1ccoc1)cn2C.CCOC(=O)c1cnc2c(c1)c(I)cn2C.COc1ccccc1N.COc1ccccc1NC(=O)c1cnc2[nH]cc(-c3ccoc3)c2c1.II.N#Cc1cnc2[nH]ccc2c1.O=C(O)c1cnc2[nH]cc(-c3ccoc3)c2c1.O=S(=O)(O)O.OB(O)c1ccoc1.[C-]#N.[C-]#N.[K+].[Na+].[OH-].[OH-].[Pd].[Zn+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H15N3O3.4C18H15P.C15H14N2O3.C12H8N2O3.C11H11IN2O2.C10H9IN2O2.C10H10N2O2.C8H5N3.C7H5BrN2.C7H9NO.C4H5BO3.C2H6O.2CN.7CH4.I2.K.Na.H2O4S.2H2O.Pd.Zn/c1-24-17-5-3-2-4-16(17)22-19(23)13-8-14-15(12-6-7-25-11-12)10-21-18(14)20-9-13;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-20-15(18)11-6-12-13(10-4-5-19-9-10)8-17(2)14(12)16-7-11;15-12(16)8-3-9-10(7-1-2-17-6-7)5-14-11(9)13-4-8;1-3-16-11(15)7-4-8-9(12)6-14(2)10(8)13-5-7;1-2-15-10(14)6-3-7-8(11)5-13-9(7)12-4-6;1-2-14-10(13)8-5-7-3-4-11-9(7)12-6-8;9-4-6-3-7-1-2-10-8(7)11-5-6;8-6-3-5-1-2-9-7(5)10-4-6;1-9-7-5-3-2-4-6(7)8;6-5(7)4-1-2-8-3-4;1-2-3;2*1-2;;;;;;;;1-2;;;1-5(2,3)4;;;;/h2-11H,1H3,(H,20,21)(H,22,23);4*1-15H;4-9H,3H2,1-2H3;1-6H,(H,13,14)(H,15,16);4-6H,3H2,1-2H3;3-5H,2H2,1H3,(H,12,13);3-6H,2H2,1H3,(H,11,12);1-3,5H,(H,10,11);1-4H,(H,9,10);2-5H,8H2,1H3;1-3,6-7H;3H,2H2,1H3;;;7*1H4;;;;(H2,1,2,3,4);2*1H2;;/q;;;;;;;;;;;;;;;2*-1;;;;;;;;;2*+1;;;;;+2/p-2
InChIKeyZOOLAFCSOYWRDI-UHFFFAOYSA-L
XLogP33.24
TPSA743.02 Ų
H-Bond Donors14
H-Bond Acceptors37
Rotatable Bonds29
Heavy Atoms248
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004122.87
LogP ≤ 533.24
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide with MolForge

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Related Compounds

potassium;sodium;zinc;benzenesulfonyl chloride;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethane;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboximidate;formohydrazide;furan-3-ylboronic acid;3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carbonitrile;3-(furan-3-yl)-1-phenylsulfanylperoxy-5-(1H-1,2,4-triazol-5-yl)pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1H-pyrrolo[2,3-b]pyridine;iodomethane;3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carbonitrile;3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;tetrakis(triphenylphosphane);dicyanide;dihydroxide
CID 161288826

Frequently Asked Questions

What is the IUPAC name of potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide?
The IUPAC name of potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide (CID 159583643) is potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide.
What is the SMILES notation for potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide?
The canonical SMILES for potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide is Brc1cnc2[nH]ccc2c1.C.C.C.C.C.C.C.CCO.CCOC(=O)c1cnc2[nH]cc(I)c2c1.CCOC(=O)c1cnc2[nH]ccc2c1.CCOC(=O)c1cnc2c(c1)c(-c1ccoc1)cn2C.CCOC(=O)c1cnc2c(c1)c(I)cn2C.COc1ccccc1N.COc1ccccc1NC(=O)c1cnc2[nH]cc(-c3ccoc3)c2c1.II.N#Cc1cnc2[nH]ccc2c1.O=C(O)c1cnc2[nH]cc(-c3ccoc3)c2c1.O=S(=O)(O)O.OB(O)c1ccoc1.[C-]#N.[C-]#N.[K+].[Na+].[OH-].[OH-].[Pd].[Zn+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide?
The InChIKey is ZOOLAFCSOYWRDI-UHFFFAOYSA-L. The full InChI is InChI=1S/C19H15N3O3.4C18H15P.C15H14N2O3.C12H8N2O3.C11H11IN2O2.C10H9IN2O2.C10H10N2O2.C8H5N3.C7H5BrN2.C7H9NO.C4H5BO3.C2H6O.2CN.7CH4.I2.K.Na.H2O4S.2H2O.Pd.Zn/c1-24-17-5-3-2-4-16(17)22-19(23)13-8-14-15(12-6-7-25-11-12)10-21-18(14)20-9-13;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-20-15(18)11-6-12-13(10-4-5-19-9-10)8-17(2)14(12)16-7-11;15-12(16)8-3-9-10(7-1-2-17-6-7)5-14-11(9)13-4-8;1-3-16-11(15)7-4-8-9(12)6-14(2)10(8)13-5-7;1-2-15-10(14)6-3-7-8(11)5-13-9(7)12-4-6;1-2-14-10(13)8-5-7-3-4-11-9(7)12-6-8;9-4-6-3-7-1-2-10-8(7)11-5-6;8-6-3-5-1-2-9-7(5)10-4-6;1-9-7-5-3-2-4-6(7)8;6-5(7)4-1-2-8-3-4;1-2-3;2*1-2;;;;;;;;1-2;;;1-5(2,3)4;;;;/h2-11H,1H3,(H,20,21)(H,22,23);4*1-15H;4-9H,3H2,1-2H3;1-6H,(H,13,14)(H,15,16);4-6H,3H2,1-2H3;3-5H,2H2,1H3,(H,12,13);3-6H,2H2,1H3,(H,11,12);1-3,5H,(H,10,11);1-4H,(H,9,10);2-5H,8H2,1H3;1-3,6-7H;3H,2H2,1H3;;;7*1H4;;;;(H2,1,2,3,4);2*1H2;;/q;;;;;;;;;;;;;;;2*-1;;;;;;;;;2*+1;;;;;+2/p-2.
What are the key properties of potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide?
potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide has a molecular weight of 4122.87 g/mol, XLogP of 33.24, 29 rotatable bonds, 14 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sodium;zinc;5-bromo-1H-pyrrolo[2,3-b]pyridine;ethanol;ethyl 3-(furan-3-yl)-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1-methylpyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate;furan-3-ylboronic acid;3-(furan-3-yl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid;methane;2-methoxyaniline;molecular iodine;palladium;1H-pyrrolo[2,3-b]pyridine-5-carbonitrile;sulfuric acid;tetrakis(triphenylphosphane);dicyanide;dihydroxide is sourced from PubChem (CID 159583643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).