2-(2-chloroanilino)-N-propionyl-3-pyridinesulfonamide

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Basic information

CAS: 55884-12-3
Standard SMILES: CCC(=O)NS(=O)(=O)c1cccnc1Nc1ccccc1Cl
InChIKey: DWXRWAATSKQWRJ-UHFFFAOYSA-N
Molecular formula: C14H14ClN3O3S
Average molar mass: 339.8 g/mol
Monoisotopic mass: 339.0444402

Names & identifiers

Preferred name: 2-(2-chloroanilino)-N-propionyl-3-pyridinesulfonamide
IUPAC: N-[[2-(2-chloroanilino)-3-pyridinyl]sulfonyl]propanamide
English name: 2-(2-chloroanilino)-N-propionyl-3-pyridinesulfonamide
Molecular formula: C14H14ClN3O3S
Molecular weight: 339.79726

Names & synonyms

55884-12-32-(2-chloroanilino)-N-propionyl-3-pyridinesulfonamidePropanamide, N-[[2-[(2-chlorophenyl)amino]-3-pyridinyl]sulfonyl]-AJ-333/25005989N-[2-(2-chloroanilino)pyridin-3-yl]sulfonylpropanamideMLS000540161HMS2310K07Oprea1_266610CHEMBL1562957REGID_for_CID_901987DTXSID30358546SMR000162109

Show more names

N-[2-(2-Chloroanilino)pyridine-3-sulfonyl]propanamide

Database identifiers

CAS: 55884-12-3
PubChem CID: 901987
DTXSID: DTXSID30358546
ChEMBL: CHEMBL1562957

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 96.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 22
Formal charge: 0
Complexity: 480

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Compound notes

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