Basic information
- Standard SMILES
COc1ccc(-c2sc(C(=O)O)cc2-c2ccc(Cl)cc2Cl)cc1- InChIKey
XEJQJYGMBVCQOM-UHFFFAOYSA-N- Molecular formula
- C18H12Cl2O3S
- Average molar mass
- 379.3 g/mol
Names & identifiers
- Preferred name
- 4-(2,4-Dichlorophenyl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid
- IUPAC
- 4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid
Names & synonyms
SCHEMBL2159048XEJQJYGMBVCQOM-UHFFFAOYSA-N4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)thiophene-2-carboxylic acid
Database identifiers
- PubChem CID
- 67299557
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 442
Related reactions
2 records
Compound notes
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