Basic information
- Standard SMILES
Cl.Cl.SCCCN1CCN(Cc2ccc(Cl)cc2)CC1- InChIKey
RZABQBDRXJHLFP-UHFFFAOYSA-N- Molecular formula
- C14H23Cl3N2S
- Average molar mass
- 357.8 g/mol
Names & identifiers
- Preferred name
- 3-[4-(4-Chlorobenzyl)piperazin-1-yl]propanethiol dihydrochloride
- IUPAC
- 3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propane-1-thiol;dihydrochloride
Names & synonyms
SCHEMBL10599078RZABQBDRXJHLFP-UHFFFAOYSA-N3-[4-(4-chlorobenzyl)piperazin- 1-yl]propanethiol dihydrochloride3-[4-(4-chlorobenzyl)piperazin--yl]propanethiol dihydrochloride3-[4-(4-chlorobenzyl)piperazin-1-yl]propanethiol dihydrochloride3-[4-(4-chlorobenzyl)piperazine-1-yl]propanethiol dihydrochloride
Database identifiers
- PubChem CID
- 13731118
Properties
Computed structural properties
- Topological polar surface area
- 7.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 224
Related reactions
29 records
Linked notes
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