Basic information
- Standard SMILES
CCOC(=O)C(=Cc1ccc(OCc2csc(-c3ccc(Cl)cc3)n2)cc1C)OCC- InChIKey
YNFVFKDBOOEHEL-UHFFFAOYSA-N- Molecular formula
- C24H24ClNO4S
- Average molar mass
- 458 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-[4-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methoxy]-2-methylphenyl]-2-ethoxyprop-2-enoate
- IUPAC
- ethyl 3-[4-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methoxy]-2-methylphenyl]-2-ethoxyprop-2-enoate
Names & synonyms
SCHEMBL6796655
Database identifiers
- PubChem CID
- 69898367
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 85.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 596
Related reactions
1 records
Compound notes
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