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77655-29-9 | 2-methyl-3-(1,3-thiazol-2-yl)thiazolidin-4-one
CAS No: 77655-29-9 Catalog No: AG008OSF MDL No:
Product Description
Catalog Number:
AG008OSF
Chemical Name:
2-methyl-3-(1,3-thiazol-2-yl)thiazolidin-4-one
CAS Number:
77655-29-9
Molecular Formula:
C7H8N2OS2
Molecular Weight:
200.2812
IUPAC Name:
2-methyl-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
InChI:
InChI=1S/C7H8N2OS2/c1-5-9(6(10)4-12-5)7-8-2-3-11-7/h2-3,5H,4H2,1H3
InChI Key:
MLYCUZOAWWTNLA-UHFFFAOYSA-N
SMILES:
O=C1CSC(N1c1nccs1)C
NSC Number:
322055
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.008g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.274g/mol
Monoisotopic Mass:
200.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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