Basic information
- Standard SMILES
Cc1cccc(N2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)c1- InChIKey
ACIPXQUMGMUWLN-UHFFFAOYSA-N- Molecular formula
- C17H17F3N6
- Average molar mass
- 362.4 g/mol
Names & identifiers
- Preferred name
- 6-[4-(3-Methylphenyl)piperazin-1-yl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
- IUPAC
- 6-[4-(3-methylphenyl)piperazin-1-yl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
Names & synonyms
1-(3-methylphenyl)-4-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperazine1166810-34-96-[4-(3-methylphenyl)piperazin-1-yl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazineSCHEMBL2267747AKOS040719365
Database identifiers
- PubChem CID
- 51301409
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 49.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 482
Related reactions
2 records
Compound notes
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