Basic information
- Standard SMILES
Br.Br.Clc1ccc2nc(NCC3CCNCC3)sc2c1- InChIKey
WYIHMPCSGXAJPO-UHFFFAOYSA-N- Molecular formula
- C13H18Br2ClN3S
- Average molar mass
- 443.6 g/mol
- Monoisotopic mass
- 440.92767
Names & identifiers
- Preferred name
- 6-chloro-N-(4-piperidinylmethyl)-2-benzothiazolamine dihydrobromide
- IUPAC
- 6-chloro-N-(piperidin-4-ylmethyl)-1,3-benzothiazol-2-amine;dihydrobromide
Names & synonyms
SCHEMBL10373120WYIHMPCSGXAJPO-UHFFFAOYSA-N6-chloro-N-(4-piperidinylmethyl)-2-benzothiazolamine dihydrobromide
Database identifiers
- PubChem CID
- 21241579
Properties
Computed structural properties
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 273
Related reactions
3 records
Compound notes
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