Basic information
- Standard SMILES
Cn1ncc(C(=O)O)c1C(=O)Nc1ccn2nc(Br)nc2c1- InChIKey
TULOWHMHLDHWQH-UHFFFAOYSA-N- Molecular formula
- C12H9BrN6O3
- Average molar mass
- 365.14 g/mol
Names & identifiers
- Preferred name
- 5-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-ylcarbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
- IUPAC
- 5-[(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-yl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
Names & synonyms
SCHEMBL9107492TULOWHMHLDHWQH-UHFFFAOYSA-N5-(2-bromo-[1,2,4]triazolo[1,5-a]pyridin-7-ylcarbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Database identifiers
- PubChem CID
- 67775634
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 466
Related reactions
4 records
Compound notes
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