Basic information
- Standard SMILES
CCC(O)C(=O)N1CCN(c2nc(-c3ccccc3O)nc3ccccc23)CC1- InChIKey
RMMDOTVNKIYQGF-UHFFFAOYSA-N- Molecular formula
- C22H24N4O3
- Average molar mass
- 392.5 g/mol
Names & identifiers
- Preferred name
- 2-Hydroxy-1-[4-[2-(2-hydroxyphenyl)quinazolin-4-yl]piperazin-1-yl]butan-1-one
- IUPAC
- 2-hydroxy-1-[4-[2-(2-hydroxyphenyl)quinazolin-4-yl]piperazin-1-yl]butan-1-one
Names & synonyms
SCHEMBL1621678
Database identifiers
- PubChem CID
- 136366671
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 554
Related reactions
1 records
Compound notes
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