1-Cyclopentyl-1,5-dihydro-6-[(1R)-1-(3-hydroxy-1-azetidinyl)ethyl]-4H-pyrazolo[3,4-d]pyrimidin-4-one
Basic information
- CAS
1236861-71-4- Standard SMILES
C[C@H](c1nc2c(cnn2C2CCCC2)c(=O)[nH]1)N1CC(O)C1- InChIKey
RFFIKJPRYRWELI-SECBINFHSA-N- Molecular formula
- C15H21N5O2
- Average molar mass
- 303.36 g/mol
- Monoisotopic mass
- 303.16952493
Names & identifiers
- Preferred name
- 1-Cyclopentyl-1,5-dihydro-6-[(1R)-1-(3-hydroxy-1-azetidinyl)ethyl]-4H-pyrazolo[3,4-d]pyrimidin-4-one
- IUPAC
- 1-cyclopentyl-6-[(1R)-1-(3-hydroxyazetidin-1-yl)ethyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
Names & synonyms
SCHEMBL3000841DTXSID3011138051-Cyclopentyl-1,5-dihydro-6-[(1R)-1-(3-hydroxy-1-azetidinyl)ethyl]-4H-pyrazolo[3,4-d]pyrimidin-4-one1-Cyclopentyl-6-[(1R)-1-(3-hydroxyazetidin-1-yl)ethyl]-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one1236861-71-4
Database identifiers
- CAS
1236861-71-4- PubChem CID
- 136124684
- DTXSID
DTXSID301113805
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 484
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…