Basic information
- Standard SMILES
COC(=O)c1ccc(-c2csc(C)n2)cc1- InChIKey
FCLVKZCJTNCSSJ-UHFFFAOYSA-N- Molecular formula
- C12H11NO2S
- Average molar mass
- 233.29 g/mol
Names & identifiers
- Preferred name
- 4-(2-Methyl-thiazol-4-yl)-benzoic acid methyl ester
- IUPAC
- methyl 4-(2-methyl-1,3-thiazol-4-yl)benzoate
Names & synonyms
805994-92-7SCHEMBL5350275FCLVKZCJTNCSSJ-UHFFFAOYSA-NMethyl 4-(2-methyl-4-thiazolyl)benzoate4-(2-methyl-thiazol-4-yl)-benzoic acid methyl ester
Database identifiers
- PubChem CID
- 21023717
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 251
Related reactions
2 records
Compound notes
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