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Home > Pyridines > 1215206-53-3
1215206-53-3 | Thiazolo[4,5-b]pyridine-2(3H)-thione, 5-methoxy-
CAS No: 1215206-53-3 Catalog No: AG00157Q MDL No:MFCD15143573
Product Description
Catalog Number:
AG00157Q
Chemical Name:
Thiazolo[4,5-b]pyridine-2(3H)-thione, 5-methoxy-
CAS Number:
1215206-53-3
Molecular Formula:
C7H6N2OS2
Molecular Weight:
198.2653
MDL Number:
MFCD15143573
IUPAC Name:
5-methoxy-3H-[1,3]thiazolo[4,5-b]pyridine-2-thione
InChI:
InChI=1S/C7H6N2OS2/c1-10-5-3-2-4-6(8-5)9-7(11)12-4/h2-3H,1H3,(H,8,9,11)
InChI Key:
HVIJNFNWSQFFFL-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)[nH]c(=S)s2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.992g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.258g/mol
Monoisotopic Mass:
197.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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