Basic information
- Standard SMILES
Cc1cccc2c(=O)nc(-c3cccc(C(=O)O)n3)sc12- InChIKey
IITBKBHSCXFOSS-UHFFFAOYSA-N- Molecular formula
- C15H10N2O3S
- Average molar mass
- 298.3 g/mol
- Monoisotopic mass
- 298.04121336
Names & identifiers
- Preferred name
- 6-(8-Methyl-4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridinecarboxylic acid
- IUPAC
- 6-(8-methyl-4-oxo-1,3-benzothiazin-2-yl)pyridine-2-carboxylic acid
Names & synonyms
SCHEMBL2963131IITBKBHSCXFOSS-UHFFFAOYSA-N6-(8-Methyl-4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridin ecarboxylic acid6-(8-Methyl-4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridinecarbo xylic acid6-(8-Methyl-4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridinecarboxylic acid
Database identifiers
- PubChem CID
- 22939375
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 480
Related reactions
6 records
Compound notes
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