Basic information
- CAS
62373-11-9- Standard SMILES
COc1cc(OC)c(NC2=Nc3ccccc3CS2)cc1Cl- InChIKey
NHPGQMUPKDQHIH-UHFFFAOYSA-N- Molecular formula
- C16H15ClN2O2S
- Average molar mass
- 334.8 g/mol
- Monoisotopic mass
- 334.0542764
Names & identifiers
- Preferred name
- N-(5-Chloro-2,4-dimethoxyphenyl)-4H-3,1-benzothiazin-2-amine
- IUPAC
- N-(5-chloro-2,4-dimethoxyphenyl)-4H-3,1-benzothiazin-2-amine
Names & synonyms
62373-11-9N-(5-Chloro-2,4-dimethoxyphenyl)-4H-3,1-benzothiazin-2-amineSCHEMBL11703851DTXSID90614574NHPGQMUPKDQHIH-UHFFFAOYSA-N2-(5-Chloro-2,4-dimethoxyanilino)-4H-3,1-benzothiazine
Database identifiers
- CAS
62373-11-9- PubChem CID
- 21484882
- DTXSID
DTXSID90614574
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 410
Related reactions
2 records
Compound notes
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