Basic information
- CAS
544463-48-1- Standard SMILES
Cc1nc(NC(=O)C=Cc2ccc(Cl)cc2Cl)sc1C- InChIKey
VBJRXBHVGRDTLM-UHFFFAOYSA-N- Molecular formula
- C14H12Cl2N2OS
- Average molar mass
- 327.2 g/mol
- Monoisotopic mass
- 326.0047396
Names & identifiers
- Preferred name
- 2-Propenamide, 3-(2,4-dichlorophenyl)-N-(4,5-dimethyl-2-thiazolyl)-
- IUPAC
- 3-(2,4-dichlorophenyl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)prop-2-enamide
Names & synonyms
3-(2,4-dichlorophenyl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)prop-2-enamide544463-48-12-Propenamide, 3-(2,4-dichlorophenyl)-N-(4,5-dimethyl-2-thiazolyl)-DTXSID80393866
Database identifiers
- CAS
544463-48-1- PubChem CID
- 3581963
- DTXSID
DTXSID80393866
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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