N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetamide

HCID 2390823

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Basic information

CAS: 380195-04-0
Standard SMILES: COc1ccc(CCNC(=O)COc2ccc(N(C)S(=O)(=O)c3ccc(C)cc3)cc2)cc1OC
InChIKey: PLGJZQJPDRYOAJ-UHFFFAOYSA-N
Molecular formula: C26H30N2O6S
Average molar mass: 498.6 g/mol
Monoisotopic mass: 498.18245785

Names & identifiers

Preferred name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetamide
IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetamide

Names & synonyms

MLS000774792SMR000365567N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetamideOprea1_227134CHEMBL1485554BDBM90609cid_2390823DTXSID901118477HMS2773D21AKOS004085779380195-04-0Z16242023

Show more names

N-homoveratryl-2-[4-[methyl(tosyl)amino]phenoxy]acetamideN-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanamideN-[2-(3,4-Dimethoxyphenyl)ethyl]-2-[4-[methyl[(4-methylphenyl)sulfonyl]amino]phenoxy]acetamideN-[2-(3,4-Dimethoxyphenyl)ethyl]-2-{4-[methyl(4-methylbenzene-1-sulfonyl)amino]phenoxy}acetamide

Database identifiers

CAS: 380195-04-0
PubChem CID: 2390823
DTXSID: DTXSID901118477
ChEMBL: CHEMBL1485554

Properties

Computed structural properties

XLogP: 4.2
Topological polar surface area: 103 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 7
Rotatable bonds: 11
Heavy atoms: 35
Formal charge: 0
Complexity: 741

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