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
- Formal charge
- 0
- Complexity
- 875
Related reactions
12 records
Compound notes
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