Basic information
- Standard SMILES
CC(C)(C)c1cc2ncnn2nc1Cl- InChIKey
PSXSNFIFCCVXII-UHFFFAOYSA-N- Molecular formula
- C9H11ClN4
- Average molar mass
- 210.66 g/mol
Names & identifiers
- Preferred name
- 6-Chloro-7-t-butyl[1,2,4]triazolo[1,5-b]pyridazine
- IUPAC
- 7-tert-butyl-6-chloro-[1,2,4]triazolo[1,5-b]pyridazine
Names & synonyms
SCHEMBL6617375PSXSNFIFCCVXII-UHFFFAOYSA-N6-chloro-7-t-butyl[1,2,4]triazolo[1,5-b]pyridazine7-t-butyl-6-chloro[1,2,4]triazolo[1,5-b]pyridazine7-tert-butyl-6-chloro[1,2,4]triazolo[1,5-b]pyridazine
Database identifiers
- PubChem CID
- 22989243
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 215
Related reactions
5 records
Compound notes
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