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89442-25-1 | 4-Thiazolidinone, 3-pyrazinyl-2-(3-pyridinyl)-
CAS No: 89442-25-1 Catalog No: AG0043FO MDL No:
Product Description
Catalog Number:
AG0043FO
Chemical Name:
4-Thiazolidinone, 3-pyrazinyl-2-(3-pyridinyl)-
CAS Number:
89442-25-1
Molecular Formula:
C12H10N4OS
Molecular Weight:
258.2990
IUPAC Name:
3-pyrazin-2-yl-2-pyridin-3-yl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C12H10N4OS/c17-11-8-18-12(9-2-1-3-13-6-9)16(11)10-7-14-4-5-15-10/h1-7,12H,8H2
InChI Key:
GDCHMQKXYZKYNF-UHFFFAOYSA-N
SMILES:
O=C1CSC(N1c1cnccn1)c1cccnc1
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.058g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.299g/mol
Monoisotopic Mass:
258.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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