Basic information
- CAS
64460-71-5- Standard SMILES
COc1cc2c(cc1OC)C(c1ccc(Cl)cc1)=NCS2- InChIKey
MGGHVJQQOJSSKI-UHFFFAOYSA-N- Molecular formula
- C16H14ClNO2S
- Average molar mass
- 319.8 g/mol
- Monoisotopic mass
- 319.0433776
Names & identifiers
- Preferred name
- 4-(4-Chlorophenyl)-6,7-dimethoxy-2H-1,3-benzothiazine
- IUPAC
- 4-(4-chlorophenyl)-6,7-dimethoxy-2H-1,3-benzothiazine
Names & synonyms
4-(4-Chlorophenyl)-6,7-dimethoxy-2H-1,3-benzothiazine64460-71-5DTXSID70494775RefChem:287966DTXCID70445585
Database identifiers
- CAS
64460-71-5- PubChem CID
- 12370169
- DTXSID
DTXSID70494775- Nikkaji
- J394.653C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 56.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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