(E)-3-(methylsulfonyl)-N-(4-(phenyldiazenyl)phenyl)benzamide

HCID 7565705

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Basic information

CAS: 896296-37-0
Standard SMILES: CS(=O)(=O)c1cccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1
InChIKey: KNPGXHPTADZAOX-UHFFFAOYSA-N
Molecular formula: C20H17N3O3S
Average molar mass: 379.4 g/mol
Monoisotopic mass: 379.09906259

Names & identifiers

Preferred name: (E)-3-(methylsulfonyl)-N-(4-(phenyldiazenyl)phenyl)benzamide
IUPAC: 3-methylsulfonyl-N-(4-phenyldiazenylphenyl)benzamide

Names & synonyms

DTXSID901039130AKOS008542178F2557-0221(E)-3-(methylsulfonyl)-N-(4-(phenyldiazenyl)phenyl)benzamideBenzamide, 3-(methylsulfonyl)-N-[4-(2-phenyldiazenyl)phenyl]-896296-37-0

Database identifiers

CAS: 896296-37-0
PubChem CID: 7565705
DTXSID: DTXSID901039130

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 96.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 27
Formal charge: 0
Complexity: 615

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