Basic information
- CAS
27691-62-9- Standard SMILES
CN(C)S(=O)(=O)c1ccc2c(c1)Sc1ccccc1N2- InChIKey
UTNUSSVWENUMCJ-UHFFFAOYSA-N- Molecular formula
- C14H14N2O2S2
- Average molar mass
- 306.4 g/mol
- Monoisotopic mass
- 306.04967004
Names & identifiers
- Preferred name
- 3-Phenothiazinesulfonamide, N,N-dimethyl-
- IUPAC
- N,N-dimethyl-10H-phenothiazine-3-sulfonamide
- English name
- 3-(Dimethylsulfamoyl)-10H-phenothiazine
- Molecular formula
- C14H14N2O2S2
- Molecular weight
- 306.4
Names & synonyms
3-Phenothiazinesulfonamide, N,N-dimethyl-27691-62-9BRN 10108773-Dimethylsulphamidophenothiazinen,n-dimethyl-10h-phenothiazine-3-sulfonamideN,N-Dimethyl-3-phenothiazinesulfonamide10H-Phenothiazine-3-sulfonamide, N,N-dimethyl-SCHEMBL11770566DTXSID801820503-Dimethylsulfamidophenothiazine3-(Dimethylsulfamoyl)-10H-phenothiazine
Database identifiers
- CAS
27691-62-9- PubChem CID
- 214099
- DTXSID
DTXSID80182050- Nikkaji
- J228.106F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 447
Physicochemical properties
- Density
- 1.3079 · 1.3079 (rough estimate)
- refractive index
- 1.636 · 1.6360 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…