Basic information
- Standard SMILES
O=C1N[C@H](CO)Cn2nc(COc3ccccc3)cc21- InChIKey
LSKPDNKZAKUNMF-NSHDSACASA-N- Molecular formula
- C14H15N3O3
- Average molar mass
- 273.29 g/mol
- Monoisotopic mass
- 273.11134135
Names & identifiers
- Preferred name
- (S)-6-hydroxymethyl-2-phenoxymethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
- IUPAC
- (6S)-6-(hydroxymethyl)-2-(phenoxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
Names & synonyms
SCHEMBL9938171LSKPDNKZAKUNMF-NSHDSACASA-N(S)-6-hydroxymethyl-2-phenoxymethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
Database identifiers
- PubChem CID
- 67974237
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
Related reactions
3 records
Compound notes
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