Basic information
- Standard SMILES
COc1ccc2nc(NC(=O)CC(=O)c3ccccc3)sc2c1- InChIKey
SKRXKJASDDAKFB-UHFFFAOYSA-N- Molecular formula
- C17H14N2O3S
- Average molar mass
- 326.4 g/mol
Names & identifiers
- Preferred name
- N-(6-methoxybenzothiazol-2-yl)-3-oxo-3-phenylpropanamide
- IUPAC
- N-(6-methoxy-1,3-benzothiazol-2-yl)-3-oxo-3-phenylpropanamide
Names & synonyms
SKRXKJASDDAKFB-UHFFFAOYSA-NN-(6-methoxybenzothiazol -2-yl)-3-oxo-3-phenylpropanamideN-(6-methoxybenzothiazol-2-yl)-3-oxo-3-phenylpropanamide
Database identifiers
- PubChem CID
- 19975336
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 440
Related reactions
15 records
Compound notes
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