Basic information
- Standard SMILES
Cc1nc(-c2cc(=O)oc3cc(C(=O)O)ccc23)cs1- InChIKey
HJRLXUSNRZQGST-UHFFFAOYSA-N- Molecular formula
- C14H9NO4S
- Average molar mass
- 287.29 g/mol
Names & identifiers
- Preferred name
- 4-(2-Methyl-1,3-thiazol-4-yl)-2-oxo-2H-chromene-7-carboxylic acid
- IUPAC
- 4-(2-methyl-1,3-thiazol-4-yl)-2-oxochromene-7-carboxylic acid
Names & synonyms
SCHEMBL758903HJRLXUSNRZQGST-UHFFFAOYSA-N4-(2-Methyl-1,3-thiazol-4-yl)-2-oxo-2H-chromene-7-carboxylic acid
Database identifiers
- PubChem CID
- 57729262
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 464
Related reactions
7 records
Compound notes
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