Home Carboxys 5-(3,4-Dimethoxyphenyl)-2-[(2-fluorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic

5-(3,4-Dimethoxyphenyl)-2-[(2-fluorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic

CAS No.:
372496-51-0
Catalog Number:
AG01F29Q
Molecular Formula:
C26H23FN2O5S
Molecular Weight:
494.5346
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
95%
1 week
United States
$163
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Product Description
Catalog Number:
AG01F29Q
Chemical Name:
5-(3,4-Dimethoxyphenyl)-2-[(2-fluorophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic
CAS Number:
372496-51-0
Molecular Formula:
C26H23FN2O5S
Molecular Weight:
494.5346
IUPAC Name:
prop-2-enyl (2E)-5-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
InChI:
InChI=1S/C26H23FN2O5S/c1-5-12-34-25(31)22-15(2)28-26-29(23(22)17-10-11-19(32-3)20(13-17)33-4)24(30)21(35-26)14-16-8-6-7-9-18(16)27/h5-11,13-14,23H,1,12H2,2-4H3/b21-14+
InChI Key:
UNWZRQMAYPRWKL-KGENOOAVSA-N
SMILES:
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccccc1F)/s2
Properties
Complexity:
948  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
494.131g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
494.537g/mol
Monoisotopic Mass:
494.131g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties