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Home > Imidazoles > 869741-32-2
869741-32-2 | 1H-Imidazo[4,5-b]thieno[3,2-e]pyridine(9CI)
CAS No: 869741-32-2 Catalog No: AG004HFN MDL No:
Product Description
Catalog Number:
AG004HFN
Chemical Name:
1H-Imidazo[4,5-b]thieno[3,2-e]pyridine(9CI)
CAS Number:
869741-32-2
Molecular Formula:
C8H5N3S
Molecular Weight:
175.2104
IUPAC Name:
12-thia-2,4,6-triazatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8,10-pentaene
InChI:
InChI=1S/C8H5N3S/c1-2-12-8-5(1)3-6-7(11-8)10-4-9-6/h1-4H,(H,9,10,11)
InChI Key:
YAYUGXHTJPNZMP-UHFFFAOYSA-N
SMILES:
c1cc2c(s1)nc1c(c2)[nH]cn1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.209g/mol
Monoisotopic Mass:
175.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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