2-(3,4-Dichloroanilino)-3-pyridinesulfonamide

HCID 325876

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Basic information

CAS: 55842-10-9
Standard SMILES: NS(=O)(=O)c1cccnc1Nc1ccc(Cl)c(Cl)c1
InChIKey: IAVSPSVAYDFADN-UHFFFAOYSA-N
Molecular formula: C11H9Cl2N3O2S
Average molar mass: 318.2 g/mol
Monoisotopic mass: 316.9792531

Names & identifiers

Preferred name: 2-(3,4-Dichloroanilino)-3-pyridinesulfonamide
IUPAC: 2-(3,4-dichloroanilino)pyridine-3-sulfonamide
English name: 2-(3,4-dichloroanilino)-3-pyridinesulfonamide
Molecular formula: C11H9Cl2N3O2S
Molecular weight: 318.17906

Names & synonyms

2-(3,4-dichloroanilino)-3-pyridinesulfonamide55842-10-92-(3,4-dichloroanilino)pyridine-3-sulfonamideNSC295457Oprea1_792471MLS000540138CHEMBL1611942DTXSID00315565HMS2311I07NSC-295457SMR000162114AJ-333/25006242

Database identifiers

CAS: 55842-10-9
PubChem CID: 325876
DTXSID: DTXSID00315565
ChEMBL: CHEMBL1611942

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 93.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 19
Formal charge: 0
Complexity: 401

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