4-[(8-Quinolinylsulfonyl)amino]benzoyl chloride
Basic information
- CAS
116834-65-2- Standard SMILES
O=C(Cl)c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1- InChIKey
TYFMVUKGUXHEKG-UHFFFAOYSA-N- Molecular formula
- C16H11ClN2O3S
- Average molar mass
- 346.8 g/mol
- Monoisotopic mass
- 346.0178911
Names & identifiers
- Preferred name
- 4-[(8-Quinolinylsulfonyl)amino]benzoyl chloride
- IUPAC
- 4-(quinolin-8-ylsulfonylamino)benzoyl chloride
Names & synonyms
DTXSID0012442634-[(8-Quinolinylsulfonyl)amino]benzoyl chloride4-[(Quinoline-8-sulfonyl)amino]benzoyl chloride116834-65-2
Database identifiers
- CAS
116834-65-2- PubChem CID
- 85566112
- DTXSID
DTXSID001244263
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 526
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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