2-Propen-1-yl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5-[4-(pentyloxy)phenyl]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
Basic information
- CAS
618091-43-3- Standard SMILES
C=CCOC(=O)C1=C(C)N=c2sc(=Cc3ccc(Cl)cc3Cl)c(=O)n2C1c1ccc(OCCCCC)cc1- InChIKey
ZZGYIEUWSLXUJS-UHFFFAOYSA-N- Molecular formula
- C29H28Cl2N2O4S
- Average molar mass
- 571.5 g/mol
- Monoisotopic mass
- 570.1146839
Names & identifiers
- Preferred name
- 2-Propen-1-yl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5-[4-(pentyloxy)phenyl]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
- IUPAC
- prop-2-enyl 2-[(2,4-dichlorophenyl)methylidene]-7-methyl-3-oxo-5-(4-pentoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Names & synonyms
DTXSID6011010572-Propen-1-yl 2-[(2,4-dichlorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5-[4-(pentyloxy)phenyl]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate618091-43-3
Database identifiers
- CAS
618091-43-3- PubChem CID
- 4473145
- DTXSID
DTXSID601101057
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 989
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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