6-methoxy-1-(oxan-2-yl)-N-(2-phenylethyl)pyrazolo[3,4-d]pyrimidin-4-amine
Basic information
- Standard SMILES
COc1nc(NCCc2ccccc2)c2cnn(C3CCCCO3)c2n1- InChIKey
RCYBQAJTXRASIF-UHFFFAOYSA-N- Molecular formula
- C19H23N5O2
- Average molar mass
- 353.4 g/mol
- Monoisotopic mass
- 353.18517499
Names & identifiers
- Preferred name
- 6-methoxy-1-(oxan-2-yl)-N-(2-phenylethyl)pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- 6-methoxy-1-(oxan-2-yl)-N-(2-phenylethyl)pyrazolo[3,4-d]pyrimidin-4-amine
Names & synonyms
NSC619122NSC-619122
Database identifiers
- PubChem CID
- 358955
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 74.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 434
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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