N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide

C111H106BrCl4F7I5N21O15S6 — CID 158459319

About N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide

N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide (PubChem CID 158459319) has the molecular formula C111H106BrCl4F7I5N21O15S6 and a molecular weight of 3155.82 g/mol. Its IUPAC name is N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide.

Molecular Properties

• Compound Name: N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide
• PubChem CID: 158459319
• Molecular Formula: C111H106BrCl4F7I5N21O15S6
• Molecular Weight: 3155.82 g/mol
• Exact Mass: 3150.96
• IUPAC Name: N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide
• SMILES: Cc1c(Cc2ccc(Br)cc2Cl)c(NS(=O)(=O)C2(CCO)CC2)cn2ccnc12.Cc1nnc2c(Cl)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3(CCO)CC3)cn12.Cc1nnc2c(Cl)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3CC3)cn12.Cn1cnc2c(Cl)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3CC3)nc21.Cn1cnc2c(F)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3(CCO)CC3)cc21.Cn1cnc2c(F)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3CC3)cc21
• InChI: InChI=1S/C20H21BrClN3O3S.C20H20F2IN3O3S.C19H19ClFIN4O3S.C18H16F2IN3O2S.2C17H15ClFIN4O2S/c1-13-16(10-14-2-3-15(21)11-17(14)22)18(12-25-8-7-23-19(13)25)24-29(27,28)20(4-5-20)6-9-26;1-26-11-24-19-17(26)10-16(25-30(28,29)20(4-5-20)6-7-27)14(18(19)22)8-12-2-3-13(23)9-15(12)21;1-11-23-24-18-17(20)14(8-12-2-3-13(22)9-15(12)21)16(10-26(11)18)25-30(28,29)19(4-5-19)6-7-27;1-24-9-22-18-16(24)8-15(23-27(25,26)12-4-5-12)13(17(18)20)6-10-2-3-11(21)7-14(10)19;1-24-8-21-15-14(18)12(6-9-2-3-10(20)7-13(9)19)16(22-17(15)24)23-27(25,26)11-4-5-11;1-9-21-22-17-16(18)13(6-10-2-3-11(20)7-14(10)19)15(8-24(9)17)23-27(25,26)12-4-5-12/h2-3,7-8,11-12,24,26H,4-6,9-10H2,1H3;2-3,9-11,25,27H,4-8H2,1H3;2-3,9-10,25,27H,4-8H2,1H3;2-3,7-9,12,23H,4-6H2,1H3;2-3,7-8,11H,4-6H2,1H3,(H,22,23);2-3,7-8,12,23H,4-6H2,1H3
• InChIKey: HEYXDKIWKTUALT-UHFFFAOYSA-N
• XLogP: 23.43
• TPSA: 481.74 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 30
• Rotatable Bonds: 36
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3155.82
LogP ≤ 5	23.43
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide?

The IUPAC name of N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide (CID 158459319) is N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide.

What is the SMILES notation for N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide?

The canonical SMILES for N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide is Cc1c(Cc2ccc(Br)cc2Cl)c(NS(=O)(=O)C2(CCO)CC2)cn2ccnc12.Cc1nnc2c(Cl)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3(CCO)CC3)cn12.Cc1nnc2c(Cl)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3CC3)cn12.Cn1cnc2c(Cl)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3CC3)nc21.Cn1cnc2c(F)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3(CCO)CC3)cc21.Cn1cnc2c(F)c(Cc3ccc(I)cc3F)c(NS(=O)(=O)C3CC3)cc21.

What is the InChIKey of N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide?

The InChIKey is HEYXDKIWKTUALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21BrClN3O3S.C20H20F2IN3O3S.C19H19ClFIN4O3S.C18H16F2IN3O2S.2C17H15ClFIN4O2S/c1-13-16(10-14-2-3-15(21)11-17(14)22)18(12-25-8-7-23-19(13)25)24-29(27,28)20(4-5-20)6-9-26;1-26-11-24-19-17(26)10-16(25-30(28,29)20(4-5-20)6-7-27)14(18(19)22)8-12-2-3-13(23)9-15(12)21;1-11-23-24-18-17(20)14(8-12-2-3-13(22)9-15(12)21)16(10-26(11)18)25-30(28,29)19(4-5-19)6-7-27;1-24-9-22-18-16(24)8-15(23-27(25,26)12-4-5-12)13(17(18)20)6-10-2-3-11(21)7-14(10)19;1-24-8-21-15-14(18)12(6-9-2-3-10(20)7-13(9)19)16(22-17(15)24)23-27(25,26)11-4-5-11;1-9-21-22-17-16(18)13(6-10-2-3-11(20)7-14(10)19)15(8-24(9)17)23-27(25,26)12-4-5-12/h2-3,7-8,11-12,24,26H,4-6,9-10H2,1H3;2-3,9-11,25,27H,4-8H2,1H3;2-3,9-10,25,27H,4-8H2,1H3;2-3,7-9,12,23H,4-6H2,1H3;2-3,7-8,11H,4-6H2,1H3,(H,22,23);2-3,7-8,12,23H,4-6H2,1H3.

What are the key properties of N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide?

N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide has a molecular weight of 3155.82 g/mol, XLogP of 23.43, 36 rotatable bonds, 9 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for N-[7-[(4-bromo-2-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-chloro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-5-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]cyclopropanesulfonamide;N-[8-chloro-7-[(2-fluoro-4-iodophenyl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]cyclopropanesulfonamide;N-[7-fluoro-6-[(2-fluoro-4-iodophenyl)methyl]-3-methylbenzimidazol-5-yl]-1-(2-hydroxyethyl)cyclopropane-1-sulfonamide is sourced from PubChem (CID 158459319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).