7-chloro-3-methylthio-2H-1,4-benzothiazine
Basic information
- Standard SMILES
CSC1=Nc2ccc(Cl)cc2SC1- InChIKey
PYBJLEJDGZLQLA-UHFFFAOYSA-N- Molecular formula
- C9H8ClNS2
- Average molar mass
- 229.8 g/mol
Names & identifiers
- Preferred name
- 7-chloro-3-methylthio-2H-1,4-benzothiazine
- IUPAC
- 7-chloro-3-methylsulfanyl-2H-1,4-benzothiazine
Names & synonyms
SCHEMBL7458637PYBJLEJDGZLQLA-UHFFFAOYSA-N7-chloro-3-methylthio-2H-1,4-benzothiazine
Database identifiers
- PubChem CID
- 12871014
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 63 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 220
Related reactions
1 records
Compound notes
Loading…