Basic information
- CAS
853727-05-6- Standard SMILES
Cc1cnc(NC(=O)Cc2ccc(C)c(C)c2)s1- InChIKey
KLXUKLYHPBIMHM-UHFFFAOYSA-N- Molecular formula
- C14H16N2OS
- Average molar mass
- 260.36 g/mol
- Monoisotopic mass
- 260.09833431
Names & identifiers
- Preferred name
- 2-(3,4-dimethylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
- IUPAC
- 2-(3,4-dimethylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
Names & synonyms
2-(3,4-dimethylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamideMLS001172960CHEMBL1550990DTXSID601322924HMS2910E14AKOS034082035853727-05-6SMR000590596AB00733698-01Z29324263
Database identifiers
- CAS
853727-05-6- PubChem CID
- 2673045
- DTXSID
DTXSID601322924- ChEMBL
CHEMBL1550990
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 298
Experimental & physicochemical properties
Solubility2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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