3-[4-(4-Chlorobenzyl)piperazin-1-yl]propanethiol dihydrochloride

HCID 13731118

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

Related reactions

29 records

Linked notes

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