Basic information
- Standard SMILES
CC(C)Cn1nc(-c2ccccc2)cc(C(=O)O)c1=O- InChIKey
FAQAXRRQVHWFOB-UHFFFAOYSA-N- Molecular formula
- C15H16N2O3
- Average molar mass
- 272.3 g/mol
Names & identifiers
- Preferred name
- 4-carboxy-2-isobutyl-6-phenyl-2H-pyridazin-3-one
- IUPAC
- 2-(2-methylpropyl)-3-oxo-6-phenylpyridazine-4-carboxylic acid
Names & synonyms
SCHEMBL1927369FAQAXRRQVHWFOB-UHFFFAOYSA-N4-carboxy-2-isobutyl-6-phenyl-2H-pyridazin-3-one
Database identifiers
- PubChem CID
- 21991608
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 460
Related reactions
3 records
Compound notes
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