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233-95-4 | Thiazolo[4,5-f]quinoxaline (8CI,9CI)
CAS No: 233-95-4 Catalog No: AG002MUL MDL No:
Product Description
Catalog Number:
AG002MUL
Chemical Name:
Thiazolo[4,5-f]quinoxaline (8CI,9CI)
CAS Number:
233-95-4
Molecular Formula:
C9H5N3S
Molecular Weight:
187.2211
IUPAC Name:
[1,3]thiazolo[4,5-f]quinoxaline
InChI:
InChI=1S/C9H5N3S/c1-2-7-9(12-5-13-7)8-6(1)10-3-4-11-8/h1-5H
InChI Key:
DHIZMHDJSSQIJP-UHFFFAOYSA-N
SMILES:
c1cnc2c(n1)ccc1c2ncs1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.22g/mol
Monoisotopic Mass:
187.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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