2-(3-Hydroxy-2H-1,4-benzothiazin-2-yl)-N-phenylethanimidic acid
Basic information
- CAS
101350-88-3- Standard SMILES
O=C(CC1Sc2ccccc2NC1=O)Nc1ccccc1- InChIKey
RVRPQUZFIPCUAD-UHFFFAOYSA-N- Molecular formula
- C16H14N2O2S
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.07759887
Names & identifiers
- Preferred name
- 2-(3-Hydroxy-2H-1,4-benzothiazin-2-yl)-N-phenylethanimidic acid
- IUPAC
- 2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-phenylacetamide
- English name
- 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)-N-phenylacetamide
- Molecular formula
- C16H14N2O2S
- Molecular weight
- 298.36
Names & synonyms
101350-88-3DTXSID209060752-(3-Hydroxy-2H-1,4-benzothiazin-2-yl)-N-phenylethanimidic acidRefChem:1061086DTXCID5013351763-Oxo-N-phenyl-2H-1,4-benzothiazine-2-acetamide2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)-N-phenylacetamideBRN 02948462-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-phenylacetamide2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-phenyl-Cambridge id 5217823Oprea1_041833
Show more names
Oprea1_120738CBDivE_004691IFLab1_000140HMS1412G08CCG-21072STK167608AKOS000623453AKOS016193624
Database identifiers
- CAS
101350-88-3- PubChem CID
- 2834468
- DTXSID
DTXSID20906075
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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