Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate
Basic information
- CAS
66441-11-0- Standard SMILES
CCOC(=O)C(C)Oc1cccc(Oc2nc3ccc(Cl)cc3s2)c1- InChIKey
MDTRRKVOSSZNCC-UHFFFAOYSA-N- Molecular formula
- C18H16ClNO4S
- Average molar mass
- 377.8 g/mol
- Monoisotopic mass
- 377.0488569
Names & identifiers
- Preferred name
- Ethyl 2-{3-[(6-chloro-1,3-benzothiazol-2-YL)oxy]phenoxy}propanoate
- IUPAC
- ethyl 2-[3-[(6-chloro-1,3-benzothiazol-2-yl)oxy]phenoxy]propanoate
Names & synonyms
SCHEMBL5933705DTXSID30985098AK-968/10816014ETHYL 2-{3-[(6-CHLORO-1,3-BENZOTHIAZOL-2-YL)OXY]PHENOXY}PROPANOATE
Database identifiers
- CAS
66441-11-0- PubChem CID
- 47937
- DTXSID
DTXSID30985098
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 85.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 455
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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