Basic information
- CAS
55841-83-3- Standard SMILES
CC(=O)NS(=O)(=O)c1cccnc1Nc1ccc(Cl)cc1- InChIKey
ILXQIIKTWWXIPM-UHFFFAOYSA-N- Molecular formula
- C13H12ClN3O3S
- Average molar mass
- 325.77 g/mol
- Monoisotopic mass
- 325.0287901
Names & identifiers
- Preferred name
- AJ-333/36115006
- IUPAC
- N-[[2-(4-chloroanilino)-3-pyridinyl]sulfonyl]acetamide
Names & synonyms
55841-83-3DTXSID80358551AJ-333/36115006RefChem:317862DTXCID00309606N-acetyl-2-(4-chloroanilino)-3-pyridinesulfonamideAcetamide, N-[[2-[(4-chlorophenyl)amino]-3-pyridinyl]sulfonyl]-N-[2-(4-chloroanilino)pyridin-3-yl]sulfonylacetamideSMR000162118Oprea1_640153MLS000540159CHEMBL1374862
Show more names
HMS2283B08N-[2-(4-Chloroanilino)pyridine-3-sulfonyl]acetamide
Database identifiers
- CAS
55841-83-3- PubChem CID
- 902012
- DTXSID
DTXSID80358551- ChEMBL
CHEMBL1374862
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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