5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C71H86B3Br2N11O14S3 — CID 158366281

About 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 158366281) has the molecular formula C71H86B3Br2N11O14S3 and a molecular weight of 1605.98 g/mol. Its IUPAC name is 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 158366281
• Molecular Formula: C71H86B3Br2N11O14S3
• Molecular Weight: 1605.98 g/mol
• Exact Mass: 1603.42
• IUPAC Name: 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• SMILES: CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CCOC(=O)c1cnc2ccc(-c3sc(C)nc3C)cn12.CCOC(=O)c1cnc2ccc(B3OC(C)(C)C(C)(C)O3)cn12.CCOC(=O)c1cnc2ccc(Br)cn12.Cc1nc(C)c(-c2ccc3ncc(C(=O)O)n3c2)s1.Cc1nc(C)c(Br)s1
• InChI: InChI=1S/C16H21BN2O4.C15H15N3O2S.C13H11N3O2S.C12H24B2O4.C10H9BrN2O2.C5H6BrNS/c1-6-21-14(20)12-9-18-13-8-7-11(10-19(12)13)17-22-15(2,3)16(4,5)23-17;1-4-20-15(19)12-7-16-13-6-5-11(8-18(12)13)14-9(2)17-10(3)21-14;1-7-12(19-8(2)15-7)9-3-4-11-14-5-10(13(17)18)16(11)6-9;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-2-15-10(14)8-5-12-9-4-3-7(11)6-13(8)9;1-3-5(6)8-4(2)7-3/h7-10H,6H2,1-5H3;5-8H,4H2,1-3H3;3-6H,1-2H3,(H,17,18);1-8H3;3-6H,2H2,1H3;1-2H3
• InChIKey: GUBKUSJYMQCBQM-UHFFFAOYSA-N
• XLogP: 14.88
• TPSA: 279.45 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 27
• Rotatable Bonds: 11
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1605.98
LogP ≤ 5	14.88
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The IUPAC name of 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 158366281) is 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

What is the SMILES notation for 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The canonical SMILES for 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CCOC(=O)c1cnc2ccc(-c3sc(C)nc3C)cn12.CCOC(=O)c1cnc2ccc(B3OC(C)(C)C(C)(C)O3)cn12.CCOC(=O)c1cnc2ccc(Br)cn12.Cc1nc(C)c(-c2ccc3ncc(C(=O)O)n3c2)s1.Cc1nc(C)c(Br)s1.

What is the InChIKey of 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The InChIKey is GUBKUSJYMQCBQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21BN2O4.C15H15N3O2S.C13H11N3O2S.C12H24B2O4.C10H9BrN2O2.C5H6BrNS/c1-6-21-14(20)12-9-18-13-8-7-11(10-19(12)13)17-22-15(2,3)16(4,5)23-17;1-4-20-15(19)12-7-16-13-6-5-11(8-18(12)13)14-9(2)17-10(3)21-14;1-7-12(19-8(2)15-7)9-3-4-11-14-5-10(13(17)18)16(11)6-9;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-2-15-10(14)8-5-12-9-4-3-7(11)6-13(8)9;1-3-5(6)8-4(2)7-3/h7-10H,6H2,1-5H3;5-8H,4H2,1-3H3;3-6H,1-2H3,(H,17,18);1-8H3;3-6H,2H2,1H3;1-2H3.

What are the key properties of 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 1605.98 g/mol, XLogP of 14.88, 11 rotatable bonds, 1 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-2,4-dimethyl-1,3-thiazole;6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(2,4-dimethyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 158366281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).