Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate

C₇₃H₆₄BrLiN₁₈O₁₀S₅ — CID 157209421

About Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate

Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate (PubChem CID 157209421) has the molecular formula C₇₃H₆₄BrLiN₁₈O₁₀S₅ and a molecular weight of 1600.61 g/mol. Its IUPAC name is lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate.

Molecular Properties

• Compound Name: Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate
• PubChem CID: 157209421
• Molecular Formula: C₇₃H₆₄BrLiN₁₈O₁₀S₅
• Molecular Weight: 1600.61 g/mol
• Exact Mass: 1598.30
• IUPAC Name: lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate
• SMILES: C.C#Cc1ccc2ncc(C(=O)OC)n2c1.COC(=O)c1cnc2ccc(C#Cc3nc(C)cs3)cn12.Cc1csc(/C=C\c2ccc3ncc(C(N)=O)n3c2)n1.Cc1csc(Br)n1.Cc1csc(C#Cc2ccc3ncc(C(=O)O)n3c2)n1.Cc1csc(C#Cc2ccc3ncc(C(N)=O)n3c2)n1.N.O.[Li+].[OH-]
• InChI: InChI=1S/C15H11N3O2S.C14H12N4OS.C14H10N4OS.C14H9N3O2S.C11H8N2O2.C4H4BrNS.CH4.Li.H3N.2H2O/c1-10-9-21-14(17-10)6-4-11-3-5-13-16-7-12(15(19)20-2)18(13)8-11;2*1-9-8-20-13(17-9)5-3-10-2-4-12-16-6-11(14(15)19)18(12)7-10;1-9-8-20-13(16-9)5-3-10-2-4-12-15-6-11(14(18)19)17(12)7-10;1-3-8-4-5-10-12-6-9(11(14)15-2)13(10)7-8;1-3-2-7-4(5)6-3;;;;;/h3,5,7-9H,1-2H3;2-8H,1H3,(H2,15,19);2,4,6-8H,1H3,(H2,15,19);2,4,6-8H,1H3,(H,18,19);1,4-7H,2H3;2H,1H3;1H4;;1H3;2*1H2/q;;;;;;;+1;;;/p-1/b;5-3-
• InChIKey: LDTFPZIILQNUDH-HCISHHSBSA-M
• XLogP: 8.57
• TPSA: 423.53 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 29
• Rotatable Bonds: 7
• Heavy Atoms: 108
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1600.61
LogP ≤ 5	8.57
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate?

The IUPAC name of Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate (CID 157209421) is lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate.

What is the SMILES notation for Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate?

The canonical SMILES for Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate is C.C#Cc1ccc2ncc(C(=O)OC)n2c1.COC(=O)c1cnc2ccc(C#Cc3nc(C)cs3)cn12.Cc1csc(/C=C\c2ccc3ncc(C(N)=O)n3c2)n1.Cc1csc(Br)n1.Cc1csc(C#Cc2ccc3ncc(C(=O)O)n3c2)n1.Cc1csc(C#Cc2ccc3ncc(C(N)=O)n3c2)n1.N.O.[Li+].[OH-].

What is the InChIKey of Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate?

The InChIKey is LDTFPZIILQNUDH-HCISHHSBSA-M. The full InChI is InChI=1S/C15H11N3O2S.C14H12N4OS.C14H10N4OS.C14H9N3O2S.C11H8N2O2.C4H4BrNS.CH4.Li.H3N.2H2O/c1-10-9-21-14(17-10)6-4-11-3-5-13-16-7-12(15(19)20-2)18(13)8-11;2*1-9-8-20-13(17-9)5-3-10-2-4-12-16-6-11(14(15)19)18(12)7-10;1-9-8-20-13(16-9)5-3-10-2-4-12-15-6-11(14(18)19)17(12)7-10;1-3-8-4-5-10-12-6-9(11(14)15-2)13(10)7-8;1-3-2-7-4(5)6-3;;;;;/h3,5,7-9H,1-2H3;2-8H,1H3,(H2,15,19);2,4,6-8H,1H3,(H2,15,19);2,4,6-8H,1H3,(H,18,19);1,4-7H,2H3;2H,1H3;1H4;;1H3;2*1H2/q;;;;;;;+1;;;/p-1/b;5-3-;;;;;;;;;.

What are the key properties of Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate?

Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate has a molecular weight of 1600.61 g/mol, XLogP of 8.57, 7 rotatable bonds, 4 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for Lithium;azane;2-bromo-4-methyl-1,3-thiazole;methane;methyl 6-ethynylimidazo[1,2-a]pyridine-3-carboxylate;methyl 6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylate;6-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(4-methyl-1,3-thiazol-2-yl)ethynyl]imidazo[1,2-a]pyridine-3-carboxylic acid;hydroxide;hydrate is sourced from PubChem (CID 157209421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 157209421 — identifiers, structure, computed properties (public domain)

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