(E)-4-(ethylsulfonyl)-N-(4-(phenyldiazenyl)phenyl)benzamide

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Basic information

CAS: 1001525-56-9
Standard SMILES: CCS(=O)(=O)c1ccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1
InChIKey: ORQVGCGLPCISKO-UHFFFAOYSA-N
Molecular formula: C21H19N3O3S
Average molar mass: 393.5 g/mol
Monoisotopic mass: 393.11471265

Names & identifiers

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

Names & synonyms

(E)-4-(ethylsulfonyl)-N-(4-(phenyldiazenyl)phenyl)benzamideDTXSID5010397641001525-56-9F2648-0685Benzamide, 4-(ethylsulfonyl)-N-[4-[(1E)-2-phenyldiazenyl]phenyl]-

Database identifiers

CAS: 1001525-56-9
PubChem CID: 7579490
DTXSID: DTXSID501039764

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 96.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 6
Heavy atoms: 28
Formal charge: 0
Complexity: 622

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