methyl 2-(5-ethoxy-2-methyl-1-benzofuran-3-amido)benzoate
AlkaPlorer ID: AK255907
Synonym: None
IUPAC Name: methyl 2-[(5-ethoxy-2-methyl-1-benzofuran-3-carbonyl)amino]benzoate
Structure
SMILES: CCOC1=CC=C2OC(C)=C(C(=O)NC3=CC=CC=C3C(=O)OC)C2=C1
InChI: InChI=1S/C20H19NO5/c1-4-25-13-9-10-17-15(11-13)18(12(2)26-17)19(22)21-16-8-6-5-7-14(16)20(23)24-3/h5-11H,4H2,1-3H3,(H,21,22)
InChIKey: YYWQYOJHVYGRIG-UHFFFAOYSA-N
Reference
A community-driven global reconstruction of human metabolism
PubChem CID: 26841536
SuperNatural Ⅲ: SN0463993
COCONUT: CNP0050020
Source
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Properties Information
Molecule Weight: 353.37400000000014
TPSA？: 77.77
MolLogP？: 4.178820000000003
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
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