Basic information
- Standard SMILES
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CCN3CCC(C)(O)CC3)n(C)c2n1- InChIKey
SLYNJLDEIBULFO-UHFFFAOYSA-N- Molecular formula
- C27H36N8O2
- Average molar mass
- 504.6 g/mol
Names & identifiers
- Preferred name
- 1-(2-(2-(2-ethyl-1H-benzo[d]imidazol-1-yl)-9-methyl-6-morpholino-9H-purin-8-yl)ethyl)-4-methylpiperidin-4-ol
- IUPAC
- 1-[2-[2-(2-ethylbenzimidazol-1-yl)-9-methyl-6-morpholin-4-ylpurin-8-yl]ethyl]-4-methylpiperidin-4-ol
Names & synonyms
SCHEMBL2674048SLYNJLDEIBULFO-UHFFFAOYSA-N1-(2-(2-(2-ethyl-1H-benzo[d]imidazol-1-yl)-9-methyl-6-morpholino-9H-purin-8-yl)ethyl)-4-methylpiperidin-4-ol
Database identifiers
- PubChem CID
- 59605734
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 761
Related reactions
3 records
Compound notes
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