Basic information
- CAS
445409-16-5- Standard SMILES
Cc1cc(Br)cc(Br)c1OCC(=O)Nc1nccs1- InChIKey
LGPSHYNUAFODGC-UHFFFAOYSA-N- Molecular formula
- C12H10Br2N2O2S
- Average molar mass
- 406.09 g/mol
- Monoisotopic mass
- 403.88297
Names & identifiers
- Preferred name
- 2-(2,4-dibromo-6-methylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
- IUPAC
- 2-(2,4-dibromo-6-methylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
- English name
- 2-(2,4-dibromo-6-methylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
- Molecular formula
- C12H10Br2N2O2S
- Molecular weight
- 406.09
Names & synonyms
2-(2,4-dibromo-6-methylphenoxy)-N-(1,3-thiazol-2-yl)acetamideOprea1_415561Oprea1_431350STK050306AKOS000490670ST039771AN-329/40926479Acetamide, 2-(2,4-dibromo-6-methylphenoxy)-N-2-thiazolyl-
Database identifiers
- CAS
445409-16-5- PubChem CID
- 1013361
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 322
Physicochemical properties
- Density
- 1.827 · 1.827±0.06 g/cm3(Predicted)
- pka
- 7.55 · 7.55±0.50(Predicted)
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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