2H-1,4-Benzothiazin-3(4H)-one, 4-(2-diethylaminoethyl)-2-phenyl-, hydrochloride
Basic information
- CAS
4734-13-8- Standard SMILES
CCN(CC)CCN1C(=O)C(c2ccccc2)Sc2ccccc21.Cl- InChIKey
WSLDGTSNHFTJEB-UHFFFAOYSA-N- Molecular formula
- C20H25ClN2OS
- Average molar mass
- 376.9 g/mol
- Monoisotopic mass
- 376.1376123
Names & identifiers
- Preferred name
- 2H-1,4-Benzothiazin-3(4H)-one, 4-(2-diethylaminoethyl)-2-phenyl-, hydrochloride
- IUPAC
- 4-[2-(diethylamino)ethyl]-2-phenyl-1,4-benzothiazin-3-one;hydrochloride
Names & synonyms
4734-13-82H-1,4-Benzothiazin-3(4H)-one, 4-(2-diethylaminoethyl)-2-phenyl-, hydrochloride4-(2-Diethylaminoethyl)-2-phenyl-2H-1,4-benzothiazin 3(4H)-one hydrochlorideRefChem:267905DTXSID909638124-[2-(Diethylamino)ethyl]-2-phenyl-2H-1,4-benzothiazin-3(4H)-one hydrochloride4-[2-(Diethylamino)ethyl]-2-phenyl-2H-1,4-benzothiazin-3(4H)-one--hydrogen chloride (1/1)
Database identifiers
- CAS
4734-13-8- PubChem CID
- 199674
- DTXSID
DTXSID90963812
Properties
Computed structural properties
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 406
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…