5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid

C107H94B2BrCl3F4N16O14 — CID 159538152

About 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid

5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid (PubChem CID 159538152) has the molecular formula C107H94B2BrCl3F4N16O14 and a molecular weight of 2111.91 g/mol. Its IUPAC name is 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid.

Molecular Properties

• Compound Name: 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid
• PubChem CID: 159538152
• Molecular Formula: C107H94B2BrCl3F4N16O14
• Molecular Weight: 2111.91 g/mol
• Exact Mass: 2108.55
• IUPAC Name: 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid
• SMILES: C.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(-c3ccc(-c4cccnc4)c(C(=O)NCC(C)C)c3)cn12.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(-c3ccc(Cl)c(C(=O)NCC(C)C)c3)cn12.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(-c3ccc(Cl)c(C(=O)O)c3)cn12.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(Br)cn12.O=C(O)c1cc(B(O)O)ccc1Cl.OB(O)c1cccnc1
• InChI: InChI=1S/C31H28FN5O2.C26H24ClFN4O2.C22H15ClFN3O3.C15H11BrFN3O.C7H6BClO4.C5H6BNO2.CH4/c1-19(2)16-35-30(38)26-15-21(8-12-25(26)22-5-4-14-34-17-22)23-9-13-27-36-28(20-6-10-24(32)11-7-20)29(31(39)33-3)37(27)18-23;1-15(2)13-30-25(33)20-12-17(6-10-21(20)27)18-7-11-22-31-23(16-4-8-19(28)9-5-16)24(26(34)29-3)32(22)14-18;1-25-21(28)20-19(12-2-6-15(24)7-3-12)26-18-9-5-14(11-27(18)20)13-4-8-17(23)16(10-13)22(29)30;1-18-15(21)14-13(9-2-5-11(17)6-3-9)19-12-7-4-10(16)8-20(12)14;9-6-2-1-4(8(12)13)3-5(6)7(10)11;8-6(9)5-2-1-3-7-4-5;/h4-15,17-19H,16H2,1-3H3,(H,33,39)(H,35,38);4-12,14-15H,13H2,1-3H3,(H,29,34)(H,30,33);2-11H,1H3,(H,25,28)(H,29,30);2-8H,1H3,(H,18,21);1-3,12-13H,(H,10,11);1-4,8-9H;1H4
• InChIKey: MDVYSEFRZISPEW-UHFFFAOYSA-N
• XLogP: 17.72
• TPSA: 425.10 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 22
• Rotatable Bonds: 22
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2111.91
LogP ≤ 5	17.72
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid?

The IUPAC name of 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid (CID 159538152) is 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid.

What is the SMILES notation for 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid?

The canonical SMILES for 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid is C.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(-c3ccc(-c4cccnc4)c(C(=O)NCC(C)C)c3)cn12.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(-c3ccc(Cl)c(C(=O)NCC(C)C)c3)cn12.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(-c3ccc(Cl)c(C(=O)O)c3)cn12.CNC(=O)c1c(-c2ccc(F)cc2)nc2ccc(Br)cn12.O=C(O)c1cc(B(O)O)ccc1Cl.OB(O)c1cccnc1.

What is the InChIKey of 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid?

The InChIKey is MDVYSEFRZISPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H28FN5O2.C26H24ClFN4O2.C22H15ClFN3O3.C15H11BrFN3O.C7H6BClO4.C5H6BNO2.CH4/c1-19(2)16-35-30(38)26-15-21(8-12-25(26)22-5-4-14-34-17-22)23-9-13-27-36-28(20-6-10-24(32)11-7-20)29(31(39)33-3)37(27)18-23;1-15(2)13-30-25(33)20-12-17(6-10-21(20)27)18-7-11-22-31-23(16-4-8-19(28)9-5-16)24(26(34)29-3)32(22)14-18;1-25-21(28)20-19(12-2-6-15(24)7-3-12)26-18-9-5-14(11-27(18)20)13-4-8-17(23)16(10-13)22(29)30;1-18-15(21)14-13(9-2-5-11(17)6-3-9)19-12-7-4-10(16)8-20(12)14;9-6-2-1-4(8(12)13)3-5(6)7(10)11;8-6(9)5-2-1-3-7-4-5;/h4-15,17-19H,16H2,1-3H3,(H,33,39)(H,35,38);4-12,14-15H,13H2,1-3H3,(H,29,34)(H,30,33);2-11H,1H3,(H,25,28)(H,29,30);2-8H,1H3,(H,18,21);1-3,12-13H,(H,10,11);1-4,8-9H;1H4.

What are the key properties of 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid?

5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid has a molecular weight of 2111.91 g/mol, XLogP of 17.72, 22 rotatable bonds, 12 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 5-borono-2-chlorobenzoic acid;6-bromo-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-chloro-5-[2-(4-fluorophenyl)-3-(methylcarbamoyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;6-[4-chloro-3-(2-methylpropylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;2-(4-fluorophenyl)-N-methyl-6-[3-(2-methylpropylcarbamoyl)-4-pyridin-3-ylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;pyridin-3-ylboronic acid is sourced from PubChem (CID 159538152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).