6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide

C71H76BBr4Cl3IN19O8S3 — CID 157328665

About 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide

6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide (PubChem CID 157328665) has the molecular formula C71H76BBr4Cl3IN19O8S3 and a molecular weight of 1983.41 g/mol. Its IUPAC name is 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide.

Molecular Properties

• Compound Name: 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide
• PubChem CID: 157328665
• Molecular Formula: C71H76BBr4Cl3IN19O8S3
• Molecular Weight: 1983.41 g/mol
• Exact Mass: 1977.02
• IUPAC Name: 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide
• SMILES: CN(C)S(=O)(=O)Cc1cc(B2OC(C)(C)C(C)(C)O2)cnc1Cl.Cc1cc(N)ncc1Br.Cc1cc2ncc(-c3cnc(Cl)c(NS(=O)(=O)N(C)C)c3)n2cc1-c1ccncc1.Cc1cc2ncc(-c3cnc(Cl)c(NS(=O)(=O)N(C)C)c3)n2cc1Br.Cc1cc2ncc(I)n2cc1Br.Cc1cc2nccn2cc1Br
• InChI: InChI=1S/C20H19ClN6O2S.C15H15BrClN5O2S.C14H22BClN2O4S.C8H6BrIN2.C8H7BrN2.C6H7BrN2/c1-13-8-19-23-11-18(27(19)12-16(13)14-4-6-22-7-5-14)15-9-17(20(21)24-10-15)25-30(28,29)26(2)3;1-9-4-14-18-7-13(22(14)8-11(9)16)10-5-12(15(17)19-6-10)20-25(23,24)21(2)3;1-13(2)14(3,4)22-15(21-13)11-7-10(12(16)17-8-11)9-23(19,20)18(5)6;1-5-2-8-11-3-7(10)12(8)4-6(5)9;1-6-4-8-10-2-3-11(8)5-7(6)9;1-4-2-6(8)9-3-5(4)7/h4-12,25H,1-3H3;4-8,20H,1-3H3;7-8H,9H2,1-6H3;2-4H,1H3;2-5H,1H3;2-3H,1H3,(H2,8,9)
• InChIKey: BFAGRIJUVWKOSE-UHFFFAOYSA-N
• XLogP: 15.55
• TPSA: 314.33 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 22
• Rotatable Bonds: 13
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1983.41
LogP ≤ 5	15.55
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide?

The IUPAC name of 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide (CID 157328665) is 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide.

What is the SMILES notation for 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide?

The canonical SMILES for 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide is CN(C)S(=O)(=O)Cc1cc(B2OC(C)(C)C(C)(C)O2)cnc1Cl.Cc1cc(N)ncc1Br.Cc1cc2ncc(-c3cnc(Cl)c(NS(=O)(=O)N(C)C)c3)n2cc1-c1ccncc1.Cc1cc2ncc(-c3cnc(Cl)c(NS(=O)(=O)N(C)C)c3)n2cc1Br.Cc1cc2ncc(I)n2cc1Br.Cc1cc2nccn2cc1Br.

What is the InChIKey of 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide?

The InChIKey is BFAGRIJUVWKOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN6O2S.C15H15BrClN5O2S.C14H22BClN2O4S.C8H6BrIN2.C8H7BrN2.C6H7BrN2/c1-13-8-19-23-11-18(27(19)12-16(13)14-4-6-22-7-5-14)15-9-17(20(21)24-10-15)25-30(28,29)26(2)3;1-9-4-14-18-7-13(22(14)8-11(9)16)10-5-12(15(17)19-6-10)20-25(23,24)21(2)3;1-13(2)14(3,4)22-15(21-13)11-7-10(12(16)17-8-11)9-23(19,20)18(5)6;1-5-2-8-11-3-7(10)12(8)4-6(5)9;1-6-4-8-10-2-3-11(8)5-7(6)9;1-4-2-6(8)9-3-5(4)7/h4-12,25H,1-3H3;4-8,20H,1-3H3;7-8H,9H2,1-6H3;2-4H,1H3;2-5H,1H3;2-3H,1H3,(H2,8,9).

What are the key properties of 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide?

6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide has a molecular weight of 1983.41 g/mol, XLogP of 15.55, 13 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;5-bromo-4-methylpyridin-2-amine;3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-methyl-6-pyridin-4-ylimidazo[1,2-a]pyridine;1-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N,N-dimethylmethanesulfonamide is sourced from PubChem (CID 157328665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).