Basic information
- CAS
618091-28-4- Standard SMILES
CCCCOc1ccc(C2C(C(=O)OCCOC)=C(C)N=c3sc(=Cc4ccc(Cl)cc4Cl)c(=O)n32)cc1- InChIKey
PDPYNYBJVVOZDH-UHFFFAOYSA-N- Molecular formula
- C28H28Cl2N2O5S
- Average molar mass
- 575.5 g/mol
- Monoisotopic mass
- 574.1095986
Names & identifiers
- Preferred name
- 2-Methoxyethyl 5-(4-butoxyphenyl)-2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
- IUPAC
- 2-methoxyethyl 5-(4-butoxyphenyl)-2-[(2,4-dichlorophenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Names & synonyms
DTXSID4011015442-Methoxyethyl 5-(4-butoxyphenyl)-2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate618091-28-4
Database identifiers
- CAS
618091-28-4- PubChem CID
- 4472917
- DTXSID
DTXSID401101544
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 963
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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