Basic information
- Standard SMILES
COc1ccc2c(OCc3nnc4ccc(Cl)nn34)ccnc2c1- InChIKey
ZKPHODPMIWSKQC-UHFFFAOYSA-N- Molecular formula
- C16H12ClN5O2
- Average molar mass
- 341.75 g/mol
- Monoisotopic mass
- 341.0679523
Names & identifiers
- Preferred name
- 4-((6-Chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)-7-methoxyquinoline
- IUPAC
- 4-[(6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy]-7-methoxyquinoline
Names & synonyms
SCHEMBL2698767ZKPHODPMIWSKQC-UHFFFAOYSA-N4-((6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)-7-methoxyquinoline
Database identifiers
- PubChem CID
- 25066992
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 74.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 431
Related reactions
44 records
Linked notes
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