acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine

C84H81BBr4Cl7N31O8 — CID 159065248

About acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine

acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine (PubChem CID 159065248) has the molecular formula C84H81BBr4Cl7N31O8 and a molecular weight of 2231.38 g/mol. Its IUPAC name is acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine.

Molecular Properties

• Compound Name: acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine
• PubChem CID: 159065248
• Molecular Formula: C84H81BBr4Cl7N31O8
• Molecular Weight: 2231.38 g/mol
• Exact Mass: 2223.15
• IUPAC Name: acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine
• SMILES: CC(=O)O.Cc1nnc2c(Cl)cc(-c3nn4c(c3C(N)=O)CCCC4)cn12.Cc1nnc2c(Cl)cc(-c3nn4c(c3C(N)=O)CNCC4)cn12.Cc1nnc2c(Cl)cc(B3OC(C)(C)C(C)(C)O3)cn12.Cc1nnc2c(Cl)cc(Br)cn12.Clc1cc(Br)cnc1Br.NNc1ncc(Br)cc1Cl.[C-]#[N+]c1ccc(CC(=O)N2CCn3nc(-c4cc(Cl)c5nnc(C)n5c4)c(C(N)=O)c3C2)cc1
• InChI: InChI=1S/C23H19ClN8O2.C15H15ClN6O.C14H14ClN7O.C13H17BClN3O2.C7H5BrClN3.C5H2Br2ClN.C5H5BrClN3.C2H4O2/c1-13-27-28-23-17(24)10-15(11-31(13)23)21-20(22(25)34)18-12-30(7-8-32(18)29-21)19(33)9-14-3-5-16(26-2)6-4-14;1-8-18-19-15-10(16)6-9(7-21(8)15)13-12(14(17)23)11-4-2-3-5-22(11)20-13;1-7-18-19-14-9(15)4-8(6-21(7)14)12-11(13(16)23)10-5-17-2-3-22(10)20-12;1-8-16-17-11-10(15)6-9(7-18(8)11)14-19-12(2,3)13(4,5)20-14;1-4-10-11-7-6(9)2-5(8)3-12(4)7;6-3-1-4(8)5(7)9-2-3;6-3-1-4(7)5(10-8)9-2-3;1-2(3)4/h3-6,10-11H,7-9,12H2,1H3,(H2,25,34);6-7H,2-5H2,1H3,(H2,17,23);4,6,17H,2-3,5H2,1H3,(H2,16,23);6-7H,1-5H3;2-3H,1H3;1-2H;1-2H,8H2,(H,9,10);1H3,(H,3,4)
• InChIKey: MTQPCKPMBCGLTN-UHFFFAOYSA-N
• XLogP: 15.11
• TPSA: 489.97 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 33
• Rotatable Bonds: 10
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2231.38
LogP ≤ 5	15.11
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine?

The IUPAC name of acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine (CID 159065248) is acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine.

What is the SMILES notation for acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine?

The canonical SMILES for acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine is CC(=O)O.Cc1nnc2c(Cl)cc(-c3nn4c(c3C(N)=O)CCCC4)cn12.Cc1nnc2c(Cl)cc(-c3nn4c(c3C(N)=O)CNCC4)cn12.Cc1nnc2c(Cl)cc(B3OC(C)(C)C(C)(C)O3)cn12.Cc1nnc2c(Cl)cc(Br)cn12.Clc1cc(Br)cnc1Br.NNc1ncc(Br)cc1Cl.[C-]#[N+]c1ccc(CC(=O)N2CCn3nc(-c4cc(Cl)c5nnc(C)n5c4)c(C(N)=O)c3C2)cc1.

What is the InChIKey of acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine?

The InChIKey is MTQPCKPMBCGLTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN8O2.C15H15ClN6O.C14H14ClN7O.C13H17BClN3O2.C7H5BrClN3.C5H2Br2ClN.C5H5BrClN3.C2H4O2/c1-13-27-28-23-17(24)10-15(11-31(13)23)21-20(22(25)34)18-12-30(7-8-32(18)29-21)19(33)9-14-3-5-16(26-2)6-4-14;1-8-18-19-15-10(16)6-9(7-21(8)15)13-12(14(17)23)11-4-2-3-5-22(11)20-13;1-7-18-19-14-9(15)4-8(6-21(7)14)12-11(13(16)23)10-5-17-2-3-22(10)20-12;1-8-16-17-11-10(15)6-9(7-18(8)11)14-19-12(2,3)13(4,5)20-14;1-4-10-11-7-6(9)2-5(8)3-12(4)7;6-3-1-4(8)5(7)9-2-3;6-3-1-4(7)5(10-8)9-2-3;1-2(3)4/h3-6,10-11H,7-9,12H2,1H3,(H2,25,34);6-7H,2-5H2,1H3,(H2,17,23);4,6,17H,2-3,5H2,1H3,(H2,16,23);6-7H,1-5H3;2-3H,1H3;1-2H;1-2H,8H2,(H,9,10);1H3,(H,3,4).

What are the key properties of acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine?

acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine has a molecular weight of 2231.38 g/mol, XLogP of 15.11, 10 rotatable bonds, 7 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for acetic acid;6-bromo-8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine;(5-bromo-3-chloro-2-pyridinyl)hydrazine;8-chloro-3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-[2-(4-isocyanophenyl)acetyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;2-(8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide;2,5-dibromo-3-chloropyridine is sourced from PubChem (CID 159065248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).