Basic information
- Standard SMILES
CCOC(=O)c1nc(C)c(-c2cccc3ccccc23)s1- InChIKey
VFNABOHEEPETOU-UHFFFAOYSA-N- Molecular formula
- C17H15NO2S
- Average molar mass
- 297.4 g/mol
Names & identifiers
- Preferred name
- 4-Methyl-5-naphthalen-1-yl-thiazole-2-carboxylic acid ethyl ester
- IUPAC
- ethyl 4-methyl-5-naphthalen-1-yl-1,3-thiazole-2-carboxylate
Names & synonyms
SCHEMBL3399928VFNABOHEEPETOU-UHFFFAOYSA-N4-methyl-5-naphthalen-1-yl-thiazole-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 59338449
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
3 records
Compound notes
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