Basic information
- Standard SMILES
CC(C)(O)C1CCN(Cc2nc3c(N4CCOCC4)nc(Cl)nc3n2C2CCCCO2)CC1- InChIKey
PZVQIVDZGRUYMJ-UHFFFAOYSA-N- Molecular formula
- C23H35ClN6O3
- Average molar mass
- 479 g/mol
Names & identifiers
- Preferred name
- 2-(1-((2-chloro-6-morpholino-9-(tetrahydro-2H-pyran-2-yl)-9H-purin-8-yl)methyl)piperidin-4-yl)propan-2-ol
- IUPAC
- 2-[1-[[2-chloro-6-morpholin-4-yl-9-(oxan-2-yl)purin-8-yl]methyl]piperidin-4-yl]propan-2-ol
Names & synonyms
SCHEMBL2112274PZVQIVDZGRUYMJ-UHFFFAOYSA-N2-(1-((2-chloro-6-morpholino-9-(tetrahydro-2H-pyran-2-yl)-9H-purin-8-yl)methyl)piperidin-4-yl)propan-2-ol
Database identifiers
- PubChem CID
- 59603539
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 646
Related reactions
3 records
Compound notes
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