2-(4-bromo-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide

HCID 2889525

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Basic information

CAS: 6177-61-3
Standard SMILES: CS(=O)(=O)N(CC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccc(Br)cc1
InChIKey: JSOVHYLFTRYGNH-UHFFFAOYSA-N
Molecular formula: C21H19BrN2O4S
Average molar mass: 475.4 g/mol
Monoisotopic mass: 474.02489

Names & identifiers

Preferred name: 2-(4-bromo-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide
IUPAC: 2-(4-bromo-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide

Names & synonyms

2-(4-bromo-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide6177-61-3CBMicro_024429Oprea1_027400DTXSID80387427CCG-14564BIM-0024552.P001N~2~-(4-Bromophenyl)-N~2~-(methanesulfonyl)-N-(4-phenoxyphenyl)glycinamide

Database identifiers

CAS: 6177-61-3
PubChem CID: 2889525
DTXSID: DTXSID80387427

Properties

Computed structural properties

XLogP: 4.2
Topological polar surface area: 84.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 29
Formal charge: 0
Complexity: 617

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