1-(2-Anilino-5-benzoyl-3-thienyl)ethanone
Basic information
- CAS
189363-78-8- Standard SMILES
CC(=O)c1cc(C(=O)c2ccccc2)sc1Nc1ccccc1- InChIKey
MQIPEVCHKYGTDQ-UHFFFAOYSA-N- Molecular formula
- C19H15NO2S
- Average molar mass
- 321.4 g/mol
- Monoisotopic mass
- 321.08234989
Names & identifiers
- Preferred name
- 1-(2-Anilino-5-benzoyl-3-thienyl)ethanone
- IUPAC
- 1-(2-anilino-5-benzoylthiophen-3-yl)ethanone
Names & synonyms
189363-78-81-(2-anilino-5-benzoyl-3-thienyl)ethanone1-[5-Benzoyl-2-(phenylamino)-3-thienyl]ethanone5670-75-7SMR0001867741-(2-anilino-5-benzoylthiophen-3-yl)ethanoneCambridge id 5670757MLS000583408CHEMBL1331760DTXSID90972146HMS2519C181-(2-Anilino-5-benzoylthiophen-3-yl)ethan-1-one
Show more names
AE-848/07788041
Database identifiers
- CAS
189363-78-8、5670-75-7- PubChem CID
- 867792
- DTXSID
DTXSID90972146- ChEMBL
CHEMBL1331760
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 74.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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