Basic information
- CAS
874585-35-0- Standard SMILES
Cc1cc(C)cc(OCC(=O)Nc2c(C)ccc3nsnc23)c1- InChIKey
UBURYYKQDMMMDR-UHFFFAOYSA-N- Molecular formula
- C17H17N3O2S
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 327.10414797
Names & identifiers
- Preferred name
- 2-(3,5-dimethylphenoxy)-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)acetamide
- IUPAC
- 2-(3,5-dimethylphenoxy)-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)acetamide
- English name
- 2-(3,5-dimethylphenoxy)-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)acetamide
- Molecular formula
- C17H17N3O2S
- Molecular weight
- 327.40078
Names & synonyms
2-(3,5-dimethylphenoxy)-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)acetamideCHEMBL2357428HMS1807K02STL385257AKOS000465222NCGC00102331-01ST50291208AG-690/15442017
Database identifiers
- CAS
874585-35-0- PubChem CID
- 3160953
- ChEMBL
CHEMBL2357428
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 413
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…