2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride

C71H67Br5ClF2N25O11S3 — CID 160879706

About 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride

2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride (PubChem CID 160879706) has the molecular formula C71H67Br5ClF2N25O11S3 and a molecular weight of 2015.65 g/mol. Its IUPAC name is 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride.

Molecular Properties

• Compound Name: 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride
• PubChem CID: 160879706
• Molecular Formula: C71H67Br5ClF2N25O11S3
• Molecular Weight: 2015.65 g/mol
• Exact Mass: 2009.02
• IUPAC Name: 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride
• SMILES: CC(C)(C)OC(=O)Cc1ccn2nc(Br)nc2c1.CCc1csc(-c2cnn(C)c2C(=O)CO)n1.CCc1csc(-c2cnn(C)c2C(=O)CO)n1.COC(=O)c1ccn2nc(Br)nc2c1.Cl.Cn1ncc(-c2nc(C(F)F)cs2)c1C(=O)Cc1ccn2nc(Br)nc2c1.Nc1ccn2nc(Br)nc2c1.O=C(O)c1ccn2nc(Br)nc2c1
• InChI: InChI=1S/C16H11BrF2N6OS.C12H14BrN3O2.2C11H13N3O2S.C8H6BrN3O2.C7H4BrN3O2.C6H5BrN4.ClH/c1-24-13(9(6-20-24)15-21-10(7-27-15)14(18)19)11(26)4-8-2-3-25-12(5-8)22-16(17)23-25;1-12(2,3)18-10(17)7-8-4-5-16-9(6-8)14-11(13)15-16;2*1-3-7-6-17-11(13-7)8-4-12-14(2)10(8)9(16)5-15;1-14-7(13)5-2-3-12-6(4-5)10-8(9)11-12;8-7-9-5-3-4(6(12)13)1-2-11(5)10-7;7-6-9-5-3-4(8)1-2-11(5)10-6;/h2-3,5-7,14H,4H2,1H3;4-6H,7H2,1-3H3;2*4,6,15H,3,5H2,1-2H3;2-4H,1H3;1-3H,(H,12,13);1-3H,8H2;1H
• InChIKey: XKRMDQDPIZEYPV-UHFFFAOYSA-N
• XLogP: 12.61
• TPSA: 450.67 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 38
• Rotatable Bonds: 17
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2015.65
LogP ≤ 5	12.61
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride?

The IUPAC name of 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride (CID 160879706) is 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride.

What is the SMILES notation for 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride?

The canonical SMILES for 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride is CC(C)(C)OC(=O)Cc1ccn2nc(Br)nc2c1.CCc1csc(-c2cnn(C)c2C(=O)CO)n1.CCc1csc(-c2cnn(C)c2C(=O)CO)n1.COC(=O)c1ccn2nc(Br)nc2c1.Cl.Cn1ncc(-c2nc(C(F)F)cs2)c1C(=O)Cc1ccn2nc(Br)nc2c1.Nc1ccn2nc(Br)nc2c1.O=C(O)c1ccn2nc(Br)nc2c1.

What is the InChIKey of 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride?

The InChIKey is XKRMDQDPIZEYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11BrF2N6OS.C12H14BrN3O2.2C11H13N3O2S.C8H6BrN3O2.C7H4BrN3O2.C6H5BrN4.ClH/c1-24-13(9(6-20-24)15-21-10(7-27-15)14(18)19)11(26)4-8-2-3-25-12(5-8)22-16(17)23-25;1-12(2,3)18-10(17)7-8-4-5-16-9(6-8)14-11(13)15-16;2*1-3-7-6-17-11(13-7)8-4-12-14(2)10(8)9(16)5-15;1-14-7(13)5-2-3-12-6(4-5)10-8(9)11-12;8-7-9-5-3-4(6(12)13)1-2-11(5)10-7;7-6-9-5-3-4(8)1-2-11(5)10-6;/h2-3,5-7,14H,4H2,1H3;4-6H,7H2,1-3H3;2*4,6,15H,3,5H2,1-2H3;2-4H,1H3;1-3H,(H,12,13);1-3H,8H2;1H.

What are the key properties of 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride?

2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride has a molecular weight of 2015.65 g/mol, XLogP of 12.61, 17 rotatable bonds, 4 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-amine;2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]ethanone;tert-butyl 2-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;bis(1-[4-(4-ethyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone);methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;hydrochloride is sourced from PubChem (CID 160879706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).