Basic information
- Standard SMILES
O=C(NC(=O)c1ccccc1Cl)Nc1cc(Cl)c2c(c1)C(F)(F)C(F)(F)S2- InChIKey
XIXUVTQDZCXIBW-UHFFFAOYSA-N- Molecular formula
- C16H8Cl2F4N2O2S
- Average molar mass
- 439.2 g/mol
- Monoisotopic mass
- 437.9619667
Names & identifiers
- Preferred name
- N-[[(7-chloro-2,2,3,3-tetrafluorobenzothien-5-yl)amino]-carbonyl]-2-chlorobenzamide
- IUPAC
- 2-chloro-N-[(7-chloro-2,2,3,3-tetrafluoro-1-benzothiophen-5-yl)carbamoyl]benzamide
Names & synonyms
N-[[(7-chloro-2,2,3,3-tetrafluorobenzothien-5-yl)amino]-carbonyl]-2-chlorobenzamideSCHEMBL10730925
Database identifiers
- PubChem CID
- 13785000
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 613
Related reactions
2 records
Compound notes
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