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89730-68-7 | Thiazolo[5,4-e]-1,2,4-triazine, 3,6-dimethyl-
CAS No: 89730-68-7 Catalog No: AG0087PA MDL No:
Product Description
Catalog Number:
AG0087PA
Chemical Name:
Thiazolo[5,4-e]-1,2,4-triazine, 3,6-dimethyl-
CAS Number:
89730-68-7
Molecular Formula:
C6H6N4S
Molecular Weight:
166.2036
IUPAC Name:
3,6-dimethyl-[1,3]thiazolo[5,4-e][1,2,4]triazine
InChI:
InChI=1S/C6H6N4S/c1-3-7-6-5(10-9-3)8-4(2)11-6/h1-2H3
InChI Key:
IFGCPXVHSUQZTQ-UHFFFAOYSA-N
SMILES:
Cc1nnc2c(n1)sc(n2)C
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.031g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.202g/mol
Monoisotopic Mass:
166.031g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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