Basic information
- Standard SMILES
CC(C)c1nnc2ccc(-c3c(-c4ccc(F)cc4F)ncn3C)nn12- InChIKey
JOZJESSTBXHJCD-UHFFFAOYSA-N- Molecular formula
- C18H16F2N6
- Average molar mass
- 354.4 g/mol
Names & identifiers
- Preferred name
- 6-(4-(2,4-Difluorophenyl)-1-methyl-1H-imidazol-5-yl)-3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazine
- IUPAC
- 6-[5-(2,4-difluorophenyl)-3-methylimidazol-4-yl]-3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazine
Names & synonyms
SCHEMBL4300766JOZJESSTBXHJCD-UHFFFAOYSA-N6-(4-(2,4-Difluorophenyl)-1-methyl-1H-imidazol-5-yl)-3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazine
Database identifiers
- PubChem CID
- 57929965
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 494
Related reactions
1 records
Compound notes
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