Basic information
- Standard SMILES
Cl.N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1- InChIKey
IMDUYENVNIXRCJ-PKLMIRHRSA-N- Molecular formula
- C19H22Cl2N4O3
- Average molar mass
- 425.3 g/mol
Names & identifiers
- Preferred name
- (2R)-2-amino-3-(4-chlorophenyl)-1-[4-(2-nitrophenyl)piperazinyl]propan-1-one hydrochloride
- IUPAC
- (2R)-2-amino-3-(4-chlorophenyl)-1-[4-(2-nitrophenyl)piperazin-1-yl]propan-1-one;hydrochloride
Names & synonyms
SCHEMBL4529692IMDUYENVNIXRCJ-PKLMIRHRSA-N(2R)-2-amino-3-(4-chlorophenyl)-1-[4-(2-nitrophenyl)piperazinyl]propan-1-one hydrochloride
Database identifiers
- PubChem CID
- 69080220
Properties
Computed structural properties
- Topological polar surface area
- 95.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 514
Related reactions
3 records
Compound notes
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