7,8-bis(4-methylphenyl)-2-isobutyl-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Basic information
- Standard SMILES
Cc1ccc(-c2ccn3c(=O)n(CC(C)C)nc3c2-c2ccc(C)cc2)cc1- InChIKey
HMKONOVLBQVSSJ-UHFFFAOYSA-N- Molecular formula
- C24H25N3O
- Average molar mass
- 371.5 g/mol
Names & identifiers
- Preferred name
- 7,8-bis(4-methylphenyl)-2-isobutyl-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
- IUPAC
- 7,8-bis(4-methylphenyl)-2-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridin-3-one
Names & synonyms
SCHEMBL4469437HMKONOVLBQVSSJ-UHFFFAOYSA-N7,8-bis(4-methylphenyl)-2-isobutyl-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Database identifiers
- PubChem CID
- 57799373
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 35.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 689
Related reactions
1 records
Compound notes
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