Basic information
- Standard SMILES
O=C1c2cc(COc3ccc(O)cc3)nn2CCN1c1ccc(F)cn1- InChIKey
PWYZJYCIELYKCM-UHFFFAOYSA-N- Molecular formula
- C18H15FN4O3
- Average molar mass
- 354.3 g/mol
- Monoisotopic mass
- 354.11281852
Names & identifiers
- Preferred name
- 5-(5-fluoro-pyridin-2-yl)-2-(4-hydroxy-phenoxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
- IUPAC
- 5-(5-fluoro-2-pyridinyl)-2-[(4-hydroxyphenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
Names & synonyms
SCHEMBL9937248PWYZJYCIELYKCM-UHFFFAOYSA-N5-(5-fluoro-pyridin-2-yl)-2-(4-hydroxy-phenoxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
Database identifiers
- PubChem CID
- 67973758
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 503
Related reactions
2 records
Compound notes
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