(S)-2-hydroxy-1-(4-(2-(2-hydroxyphenyl)-7-methylquinazolin-4-yl)piperazin-1-yl)butan-1-one hydrochloride
Basic information
- Standard SMILES
CC[C@H](O)C(=O)N1CCN(c2nc(-c3ccccc3O)nc3cc(C)ccc23)CC1.Cl- InChIKey
CUVZRYNDYDHTBG-FYZYNONXSA-N- Molecular formula
- C23H27ClN4O3
- Average molar mass
- 442.9 g/mol
Names & identifiers
- Preferred name
- (S)-2-hydroxy-1-(4-(2-(2-hydroxyphenyl)-7-methylquinazolin-4-yl)piperazin-1-yl)butan-1-one hydrochloride
- IUPAC
- (2S)-2-hydroxy-1-[4-[2-(2-hydroxyphenyl)-7-methylquinazolin-4-yl]piperazin-1-yl]butan-1-one;hydrochloride
Names & synonyms
SCHEMBL1623836CUVZRYNDYDHTBG-FYZYNONXSA-N(S)-2-hydroxy-1-(4-(2-(2-hydroxyphenyl)-7-methylquinazolin-4-yl)piperazin-1-yl)butan-1-one hydrochloride
Database identifiers
- PubChem CID
- 136366900
Properties
Computed structural properties
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 583
Related reactions
2 records
Compound notes
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