Basic information
- Standard SMILES
N#Cc1ccccc1N1CCN(Cc2nc3ncccc3o2)CC1- InChIKey
CRDSNIKZDXAALT-UHFFFAOYSA-N- Molecular formula
- C18H17N5O
- Average molar mass
- 319.4 g/mol
Names & identifiers
- Preferred name
- 2-[4-([1,3]Oxazolo[4,5-b]pyridin-2-ylmethyl)piperazin-1-yl]benzonitrile
- IUPAC
- 2-[4-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)piperazin-1-yl]benzonitrile
Names & synonyms
SCHEMBL4818493
Database identifiers
- PubChem CID
- 10041630
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 69.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 469
Related reactions
1 records
Compound notes
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