Basic information
- Standard SMILES
COc1ccc2cc(C(=O)C(C)N3CCN(CCc4ccccc4)CC3)ccc2c1Cl.Cl.Cl- InChIKey
CKGJLVFNHUDGIK-UHFFFAOYSA-N- Molecular formula
- C26H31Cl3N2O2
- Average molar mass
- 509.9 g/mol
Names & identifiers
- Preferred name
- N1-phenylethyl-N4-[1-(5-chloro-6-methoxy-2-naphthoyl)ethyl]piperazine dihydrochloride
- IUPAC
- 1-(5-chloro-6-methoxynaphthalen-2-yl)-2-[4-(2-phenylethyl)piperazin-1-yl]propan-1-one;dihydrochloride
Names & synonyms
SCHEMBL4812693CKGJLVFNHUDGIK-UHFFFAOYSA-NN1-phenylethyl-N4-[1-(5-chloro-6-methoxy-2-naphthoyl)ethyl]piperazine dihydrochloride
Database identifiers
- PubChem CID
- 69200998
Properties
Computed structural properties
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 574
Related reactions
1 records
Compound notes
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