ethyl (2Z)-2-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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Basic information

CAS: 5673-55-2
Standard SMILES: CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccccc3OCc3ccccc3Cl)c(=O)n2C1c1ccc(OC)cc1
InChIKey: LHACVGBFVCRQME-ONUIUJJFSA-N
Molecular formula: C31H27ClN2O5S
Average molar mass: 575.1 g/mol
Monoisotopic mass: 574.1329208

Names & identifiers

Preferred name: ethyl (2Z)-2-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC: ethyl (2Z)-2-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Names & synonyms

5673-55-2ethyl (2Z)-2-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylateethyl 2-{2-[(2-chlorobenzyl)oxy]benzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylateAC1NSLVNDTXSID90416590MFCD01532665AKOS001485924AKOS021986472SR-01000411726SR-01000411726-1Ethyl (2Z)-2-({2-[(2-chlorophenyl)methoxy]phenyl}methylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylateETHYL (2Z)-2-({2-[(2-CHLOROPHENYL)METHOXY]PHENYL}METHYLIDENE)-5-(4-METHOXYPHENYL)-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE

Database identifiers

CAS: 5673-55-2
PubChem CID: 5336151
DTXSID: DTXSID90416590

Properties

Computed structural properties

XLogP: 6.5
Topological polar surface area: 103 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 9
Heavy atoms: 40
Formal charge: 0
Complexity: 1,040

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Compound notes

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