Ethyl 5-(2-methoxynaphthalen-1-yl)-2-[(3-methoxyphenyl)methylidene]-3-oxo-7-propyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

HCID 5226463

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Basic information

CAS: 6465-39-0
Standard SMILES: CCCC1=C(C(=O)OCC)C(c2c(OC)ccc3ccccc23)n2c(sc(=Cc3cccc(OC)c3)c2=O)=N1
InChIKey: JORKQNASMPJDPL-UHFFFAOYSA-N
Molecular formula: C31H30N2O5S
Average molar mass: 542.6 g/mol
Monoisotopic mass: 542.18754324

Names & identifiers

Preferred name: Ethyl 5-(2-methoxynaphthalen-1-yl)-2-[(3-methoxyphenyl)methylidene]-3-oxo-7-propyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC: ethyl 5-(2-methoxynaphthalen-1-yl)-2-[(3-methoxyphenyl)methylidene]-3-oxo-7-propyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Names & synonyms

6465-39-0Oprea1_562224DTXSID50411465Ethyl 5-(2-methoxynaphthalen-1-yl)-2-[(3-methoxyphenyl)methylidene]-3-oxo-7-propyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Database identifiers

CAS: 6465-39-0
PubChem CID: 5226463
DTXSID: DTXSID50411465

Properties

Computed structural properties

XLogP: 6.4
Topological polar surface area: 103 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 9
Heavy atoms: 39
Formal charge: 0
Complexity: 1,020

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