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Basic information
- Standard SMILES
CC(C)C[C@@H](O)C(=O)N1CCN(c2nc(-c3ccccc3O)nc3ccccc23)CC1.Cl- InChIKey
FLLQCFNOYKKZTR-ZMBIFBSDSA-N- Molecular formula
- C24H29ClN4O3
- Average molar mass
- 457 g/mol
- Monoisotopic mass
- 456.1928185
Names & identifiers
- Preferred name
- (R)-2-hydroxy-1-(4-(2-(2-hydroxyphenyl)quinazolin-4-yl)piperazin-1-yl)-4-methylpentan-1-one hydrochloride
- IUPAC
- (2R)-2-hydroxy-1-[4-[2-(2-hydroxyphenyl)quinazolin-4-yl]piperazin-1-yl]-4-methylpentan-1-one;hydrochloride
Names & synonyms
SCHEMBL1622839FLLQCFNOYKKZTR-ZMBIFBSDSA-N(R)-2-hydroxy-1-(4-(2-(2-hydroxyphenyl)quinazolin-4-yl)piperazin-1-yl)-4-methylpentan-1-one hydrochloride
Database identifiers
- PubChem CID
- 136366759
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 595
Related reactions
2 records
Compound notes
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