Ethyl 2-[(3-ethoxy-4-hydroxyphenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
Basic information
- CAS
425605-73-8- Standard SMILES
CCOC(=O)C1=C(C)N=c2sc(=Cc3ccc(O)c(OCC)c3)c(=O)n2C1c1cccs1- InChIKey
JQWMWERNVONWHC-UHFFFAOYSA-N- Molecular formula
- C23H22N2O5S2
- Average molar mass
- 470.6 g/mol
- Monoisotopic mass
- 470.09701415
Names & identifiers
- Preferred name
- Ethyl 2-[(3-ethoxy-4-hydroxyphenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
- IUPAC
- ethyl 2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Names & synonyms
Oprea1_629205DTXSID301102787425605-73-8Ethyl 2-[(3-ethoxy-4-hydroxyphenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
Database identifiers
- CAS
425605-73-8- PubChem CID
- 2889864
- DTXSID
DTXSID301102787
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 855
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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