N-[1-(4-fluorophenyl)ethyl]-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetamide
Basic information
- CAS
851284-16-7- Standard SMILES
Cc1csc(SCC(=O)NC(C)c2ccc(F)cc2)n1- InChIKey
RKCXADFPHKPACJ-UHFFFAOYSA-N- Molecular formula
- C14H15FN2OS2
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.06098362
Names & identifiers
- Preferred name
- N-[1-(4-fluorophenyl)ethyl]-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetamide
- IUPAC
- N-[1-(4-fluorophenyl)ethyl]-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetamide
Names & synonyms
N-[1-(4-fluorophenyl)ethyl]-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetamideMLS001010728CHEMBL1724313DTXSID901329105HMS2732K09AKOS017026389851284-16-7SMR000385125SR-01000062932SR-01000062932-1Z25109181
Database identifiers
- CAS
851284-16-7- PubChem CID
- 4881245
- DTXSID
DTXSID901329105- ChEMBL
CHEMBL1724313
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Experimental & physicochemical properties
Solubility38.8 [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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