Basic information
- Standard SMILES
COC(=O)c1ccc2c(-c3csc(C)n3)cc(=O)oc2c1- InChIKey
GXQBHNVTIJDQPM-UHFFFAOYSA-N- Molecular formula
- C15H11NO4S
- Average molar mass
- 301.3 g/mol
Names & identifiers
- Preferred name
- Methyl 4-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-chromene-7-carboxylate
- IUPAC
- methyl 4-(2-methyl-1,3-thiazol-4-yl)-2-oxochromene-7-carboxylate
Names & synonyms
SCHEMBL4078521GXQBHNVTIJDQPM-UHFFFAOYSA-NMethyl 4-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-chromene-7-carboxylate
Database identifiers
- PubChem CID
- 57729247
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 478
Related reactions
3 records
Compound notes
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