Basic information
- Standard SMILES
Clc1ccc2nc(NCC3CCNCC3)sc2c1- InChIKey
XBJGHGDUJLURCP-UHFFFAOYSA-N- Molecular formula
- C13H16ClN3S
- Average molar mass
- 281.8 g/mol
Names & identifiers
- Preferred name
- 6-chloro-N-(piperidin-4-ylmethyl)-1,3-benzothiazol-2-amine
- IUPAC
- 6-chloro-N-(piperidin-4-ylmethyl)-1,3-benzothiazol-2-amine
Names & synonyms
SCHEMBL4168366
Database identifiers
- PubChem CID
- 21241580
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 273
Related reactions
1 records
Compound notes
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