2-(Piperazin-1-yl)-1-(thietan-3-yl)-1H-benzimidazole--hydrogen chloride (1/2)
Basic information
- CAS
182193-15-3- Standard SMILES
Cl.Cl.c1ccc2c(c1)nc(N1CCNCC1)n2C1CSC1- InChIKey
PVZAXBQRVCGBBV-UHFFFAOYSA-N- Molecular formula
- C14H20Cl2N4S
- Average molar mass
- 347.3 g/mol
- Monoisotopic mass
- 346.0785732
Names & identifiers
- Preferred name
- 2-(Piperazin-1-yl)-1-(thietan-3-yl)-1H-benzimidazole--hydrogen chloride (1/2)
- IUPAC
- 2-piperazin-1-yl-1-(thietan-3-yl)benzimidazole;dihydrochloride
Names & synonyms
182193-15-3DTXSID209395402-(Piperazin-1-yl)-1-(thietan-3-yl)-1H-benzimidazole--hydrogen chloride (1/2)RefChem:1061988DTXCID0013680352-(1-Piperazinyl)-1-(3-thietanyl)-1H-benzimidazole dihydrochloride2-Piperazino-1-(thietan-3-yl)benzimidazole dihydrochloride1H-Benzimidazole, 2-(1-piperazinyl)-1-(3-thietanyl)-, dihydrochloride2-(Piperazin-1-yl)-1-(thietan-3-yl)-1H-1,3-benzimidazole--hydrogen chloride (1/2)
Database identifiers
- CAS
182193-15-3- PubChem CID
- 3075465
- DTXSID
DTXSID20939540
Properties
Computed structural properties
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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