Basic information
- Standard SMILES
CCOC(=O)c1sc(N)nc1-c1ccc(Cl)cc1Cl- InChIKey
QQVKHATXTVCQBL-UHFFFAOYSA-N- Molecular formula
- C12H10Cl2N2O2S
- Average molar mass
- 317.2 g/mol
- Monoisotopic mass
- 315.9840041
Names & identifiers
- Preferred name
- Ethyl 2-amino-4-(2,4-dichlorophenyl)-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 2-amino-4-(2,4-dichlorophenyl)-1,3-thiazole-5-carboxylate
Names & synonyms
SCHEMBL954378QQVKHATXTVCQBL-UHFFFAOYSA-Nethyl 2-amino-4-(2,4-dichlorophenyl)-1,3-thiazole-5-carboxylate
Database identifiers
- PubChem CID
- 58094863
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 335
Related reactions
2 records
Compound notes
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