2-[5-(2-Cyano-4-fluorophenoxy)-indazol-1-yl]-N,N-dimethylacetamide
Basic information
- Standard SMILES
CN(C)C(=O)Cn1ncc2cc(Oc3ccc(F)cc3C#N)ccc21- InChIKey
MMQVKEPQDSKINP-UHFFFAOYSA-N- Molecular formula
- C18H15FN4O2
- Average molar mass
- 338.3 g/mol
- Monoisotopic mass
- 338.1179039
Names & identifiers
- Preferred name
- 2-[5-(2-Cyano-4-fluorophenoxy)-indazol-1-yl]-N,N-dimethylacetamide
- IUPAC
- 2-[5-(2-cyano-4-fluorophenoxy)indazol-1-yl]-N,N-dimethylacetamide
Names & synonyms
SCHEMBL2441913MMQVKEPQDSKINP-UHFFFAOYSA-N2-[5-(2-Cyano-4-fluorophenoxy)-indazol-1-yl]-N,N-dimethylacetamide
Database identifiers
- PubChem CID
- 67409487
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 71.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 534
Related reactions
10 records
Compound notes
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