N-benzyl-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzenesulfonamide

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Basic information

CAS: 756126-59-7
Standard SMILES: O=C(COc1ccc(S(=O)(=O)NCc2ccccc2)cc1)N1CCCC1
InChIKey: XCMQECLXJYDMHC-UHFFFAOYSA-N
Molecular formula: C19H22N2O4S
Average molar mass: 374.5 g/mol
Monoisotopic mass: 374.13002836

Names & identifiers

Preferred name: N-benzyl-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzenesulfonamide
IUPAC: N-benzyl-4-(2-oxo-2-pyrrolidin-1-ylethoxy)benzenesulfonamide

Names & synonyms

BAS 07208735DTXSID501156835HMS1705P15N-benzyl-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzenesulfonamideSTK133983AKOS000606647756126-59-7N-Benzyl-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzene-1-sulfonamide4-[2-Oxo-2-(1-pyrrolidinyl)ethoxy]-N-(phenylmethyl)benzenesulfonamide

Database identifiers

CAS: 756126-59-7
PubChem CID: 1088535
DTXSID: DTXSID501156835

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 84.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 26
Formal charge: 0
Complexity: 540

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Compound notes

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