Basic information
- Standard SMILES
Cc1ccc(C(=O)NC(CN2CCN(Cc3ccc(Cl)c(Cl)c3)C(C)C2)C(C)C)cc1.Cl.Cl- InChIKey
UPLYVBKOEUJUCB-UHFFFAOYSA-N- Molecular formula
- C25H35Cl4N3O
- Average molar mass
- 535.4 g/mol
Names & identifiers
- Preferred name
- n-{1(Rs)-[3-methyl-4-(3,4-dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride salt
- IUPAC
- N-[1-[4-[(3,4-dichlorophenyl)methyl]-3-methylpiperazin-1-yl]-3-methylbutan-2-yl]-4-methylbenzamide;dihydrochloride
Names & synonyms
SCHEMBL5741285UPLYVBKOEUJUCB-UHFFFAOYSA-Nn-{1(rs)-[3-methyl-4-(3,4-dichlorobenzyl)piperazin-1-ylmethyl]-2-methylpropyl}-4-methylbenzamide dihydrochloride salt
Database identifiers
- PubChem CID
- 22257752
Properties
Computed structural properties
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 567
Related reactions
3 records
Compound notes
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