3-(3,5-Dimethoxyphenyl)-2-{4-[4-(2,4-dioxothiazolidin-5-ylidenemethyl)-phenoxy]-phenyl}-acrylic acid methyl ester

HCID 73197848

Basic information

Standard SMILES
COC(=O)C(=Cc1cc(OC)cc(OC)c1)c1ccc(Oc2ccc(C=C3SC(=O)NC3=O)cc2)cc1
InChIKey
NQMQMUPVBGQKSM-UHFFFAOYSA-N
Molecular formula
C28H23NO7S
Average molar mass
517.6 g/mol

Names & identifiers

Preferred name
3-(3,5-Dimethoxyphenyl)-2-{4-[4-(2,4-dioxothiazolidin-5-ylidenemethyl)-phenoxy]-phenyl}-acrylic acid methyl ester
IUPAC
methyl 3-(3,5-dimethoxyphenyl)-2-[4-[4-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]phenyl]prop-2-enoate

Names & synonyms

SCHEMBL3793562NQMQMUPVBGQKSM-UHFFFAOYSA-N3-(3,5-dimethoxy-phenyl)-2-{4-[4-(2,4-dioxo-thiazolidin-5-ylidenemethyl)-phenoxy]-phenyl}-acrylic acid methyl ester3-(3,5-dimethoxy-phenyl)-2-{4-[4-(2,4-dioxo-thiazolidin-5-ylidenemethyl)-phenoxyl]-phenyl}-acrylic acid methyl ester3-(3,5-dimethoxy-phenyl)-2-{4-[4-(2,4-dioxo-thiazolidin-5-ylidenmethyl) -phenoxy]-phenyl}-acrylic acid methyl ester3-(3,5-Dimethoxyphenyl)-2-{4-[4-(2,4-dioxothiazolidin-5-ylidenemethyl)-phenoxy]-phenyl}-acrylic acid methyl ester

Database identifiers

PubChem CID
73197848

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
125 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
37

Related reactions

12 records

Compound notes

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