3-chloro-N-ethyl-6-methyl-1-benzothiophene-2-carboxamide
Basic information
- CAS
6124-48-7- Standard SMILES
CCNC(=O)c1sc2cc(C)ccc2c1Cl- InChIKey
LVJNWRAKBUQZTM-UHFFFAOYSA-N- Molecular formula
- C12H12ClNOS
- Average molar mass
- 253.75 g/mol
- Monoisotopic mass
- 253.0328129
Names & identifiers
- Preferred name
- 3-chloro-N-ethyl-6-methyl-1-benzothiophene-2-carboxamide
- IUPAC
- 3-chloro-N-ethyl-6-methyl-1-benzothiophene-2-carboxamide
Names & synonyms
3-chloro-N-ethyl-6-methyl-1-benzothiophene-2-carboxamide6124-48-7MLS000684867SMR000268327Opera_ID_754CBMicro_046225Cambridge id 6124487CHEMBL1371511DTXSID90976745HMS2596I03HMS3380F06STK426907
Show more names
AKOS003272230NCGC00297092-01BIM-0046290.P001ST50920377AB00614860-08SR-01000228341SR-01000228341-1(3-chloro-6-methylbenzo[b]thiophen-2-yl)-N-ethylcarboxamide
Database identifiers
- CAS
6124-48-7- PubChem CID
- 874448
- DTXSID
DTXSID90976745- ChEMBL
CHEMBL1371511
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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