Basic information
- Standard SMILES
Brc1ccc(C2NCCCS2)cc1- InChIKey
LENWCEQCAKXHIR-UHFFFAOYSA-N- Molecular formula
- C10H12BrNS
- Average molar mass
- 258.18 g/mol
Names & identifiers
- Preferred name
- 2-(4-bromophenyl)tetrahydro-2H-1,3-thiazine
- IUPAC
- 2-(4-bromophenyl)-1,3-thiazinane
Names & synonyms
SCHEMBL11397176LENWCEQCAKXHIR-UHFFFAOYSA-NAKOS0155612442-(4-bromophenyl)tetrahydro-2H-1,3-thiazine
Database identifiers
- PubChem CID
- 20569653
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
Related reactions
2 records
Compound notes
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