Basic information
- CAS
625106-13-0- Standard SMILES
CC(=O)Nc1cccc(OCc2nc3ccccc3s2)c1- InChIKey
MLPYZPHLGNVRFR-UHFFFAOYSA-N- Molecular formula
- C16H14N2O2S
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.07759887
Names & identifiers
- Preferred name
- N-[3-(2-Benzothiazolylmethoxy)phenyl]acetamide
- IUPAC
- N-[3-(1,3-benzothiazol-2-ylmethoxy)phenyl]acetamide
Names & synonyms
N-[3-(2-Benzothiazolylmethoxy)phenyl]acetamideDTXSID401249041625106-13-0N-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}acetamide
Database identifiers
- CAS
625106-13-0- PubChem CID
- 7698043
- DTXSID
DTXSID401249041
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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