amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid

C56H42Br4N14O7 — CID 158674525

About amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid

amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid (PubChem CID 158674525) has the molecular formula C56H42Br4N14O7 and a molecular weight of 1342.66 g/mol. Its IUPAC name is amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid.

Molecular Properties

• Compound Name: amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid
• PubChem CID: 158674525
• Molecular Formula: C56H42Br4N14O7
• Molecular Weight: 1342.66 g/mol
• Exact Mass: 1338.01
• IUPAC Name: amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid
• SMILES: Cc1cccc(-n2cc3c(C(=O)O)cc(Br)cc3n2)n1.Cc1cccc(-n2cc3c(C(=O)ON)cc(Br)cc3n2)n1.Cc1cccc(-n2ncc3c(C(=O)O)cc(Br)cc32)n1.Cc1cccc(-n2ncc3c(C(N)=O)cc(Br)cc32)n1
• InChI: InChI=1S/C14H11BrN4O2.C14H11BrN4O.2C14H10BrN3O2/c1-8-3-2-4-13(17-8)19-7-11-10(14(20)21-16)5-9(15)6-12(11)18-19;1-8-3-2-4-13(18-8)19-12-6-9(15)5-10(14(16)20)11(12)7-17-19;1-8-3-2-4-13(16-8)18-7-11-10(14(19)20)5-9(15)6-12(11)17-18;1-8-3-2-4-13(17-8)18-12-6-9(15)5-10(14(19)20)11(12)7-16-18/h2-7H,16H2,1H3;2-7H,1H3,(H2,16,20);2*2-7H,1H3,(H,19,20)
• InChIKey: IEISXRVGIVQPLB-UHFFFAOYSA-N
• XLogP: 11.49
• TPSA: 292.85 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 18
• Rotatable Bonds: 8
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1342.66
LogP ≤ 5	11.49
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid?

The IUPAC name of amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid (CID 158674525) is amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid.

What is the SMILES notation for amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid?

The canonical SMILES for amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid is Cc1cccc(-n2cc3c(C(=O)O)cc(Br)cc3n2)n1.Cc1cccc(-n2cc3c(C(=O)ON)cc(Br)cc3n2)n1.Cc1cccc(-n2ncc3c(C(=O)O)cc(Br)cc32)n1.Cc1cccc(-n2ncc3c(C(N)=O)cc(Br)cc32)n1.

What is the InChIKey of amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid?

The InChIKey is IEISXRVGIVQPLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN4O2.C14H11BrN4O.2C14H10BrN3O2/c1-8-3-2-4-13(17-8)19-7-11-10(14(20)21-16)5-9(15)6-12(11)18-19;1-8-3-2-4-13(18-8)19-12-6-9(15)5-10(14(16)20)11(12)7-17-19;1-8-3-2-4-13(16-8)18-7-11-10(14(19)20)5-9(15)6-12(11)17-18;1-8-3-2-4-13(17-8)18-12-6-9(15)5-10(14(19)20)11(12)7-16-18/h2-7H,16H2,1H3;2-7H,1H3,(H2,16,20);2*2-7H,1H3,(H,19,20).

What are the key properties of amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid?

amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid has a molecular weight of 1342.66 g/mol, XLogP of 11.49, 8 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for amino 6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylate;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxamide;6-bromo-1-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid;6-bromo-2-(6-methyl-2-pyridinyl)indazole-4-carboxylic acid is sourced from PubChem (CID 158674525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).