N-[(2-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide

Substructure search Find similar structures

Basic information

CAS: 851288-06-7
Standard SMILES: COc1ccccc1CN(C)C(=O)c1cc2ccccc2o1
InChIKey: AFIZXKRRUMBXPC-UHFFFAOYSA-N
Molecular formula: C18H17NO3
Average molar mass: 295.3 g/mol
Monoisotopic mass: 295.1208434

Names & identifiers

Preferred name: N-[(2-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide
IUPAC: N-[(2-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide

Names & synonyms

N-[(2-methoxyphenyl)methyl]-N-methyl-1-benzofuran-2-carboxamideMLS001172158CHEMBL1562887DTXSID401326249HMS2902N08AKOS034134254851288-06-7SMR000591062Z30466846

Database identifiers

CAS: 851288-06-7
PubChem CID: 4881291
DTXSID: DTXSID401326249
ChEMBL: CHEMBL1562887

Properties

Computed structural properties

XLogP: 3.6
Topological polar surface area: 42.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 22
Formal charge: 0
Complexity: 387

Experimental & physicochemical properties

Solubility28.7 [ug/mL] (The mean of the results at pH 7.4)

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…