Basic information
- Standard SMILES
COc1cc(OC)c(-c2cc3ccccc3s2)cc1C=CC(=O)c1cc(OC)c(O[Si](C)(C)C(C)(C)C)c(OC)c1- InChIKey
WLUGUCPPEPZJDT-UHFFFAOYSA-N- Molecular formula
- C33H38O6SSi
- Average molar mass
- 590.8 g/mol
- Monoisotopic mass
- 590.21583664
Names & identifiers
- Preferred name
- 3-[5-(Benzo[b]thien-2-yl)2,4-dimethoxyphenyl]-1-(4-tert-butyldimethylsiloxy-3,5-dimethoxyphenyl)-2-propen-1-one
- IUPAC
- 3-[5-(1-benzothiophen-2-yl)-2,4-dimethoxyphenyl]-1-[4-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethoxyphenyl]prop-2-en-1-one
Names & synonyms
SCHEMBL5960623WLUGUCPPEPZJDT-UHFFFAOYSA-N3-[5-(benzo[b]thien-2-yl)2,4-dimethoxyphenyl]-1-(4-ter-butyldimethylsiloxy-3,5-dimethoxyphenyl)-2-propen-1-one3-[5-(benzo[b]thien-2-yl)2,4-dimethoxyphenyl]-1-(4-tert-butyldimethylsiloxy-3,5-dimethoxyphenyl)-2-propen-1-one
Database identifiers
- PubChem CID
- 69620906
Properties
Computed structural properties
- Topological polar surface area
- 91.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 875
Related reactions
2 records
Compound notes
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