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26542-69-8 | Thiazolo[3,2-b][1,2,4]triazole, 6-methyl-2-phenyl-
CAS No: 26542-69-8 Catalog No: AG002TM6 MDL No:
Product Description
Catalog Number:
AG002TM6
Chemical Name:
Thiazolo[3,2-b][1,2,4]triazole, 6-methyl-2-phenyl-
CAS Number:
26542-69-8
Molecular Formula:
C11H9N3S
Molecular Weight:
215.2743
IUPAC Name:
6-methyl-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazole
InChI:
InChI=1S/C11H9N3S/c1-8-7-15-11-12-10(13-14(8)11)9-5-3-2-4-6-9/h2-7H,1H3
InChI Key:
DUVAMOWJTDFUKS-UHFFFAOYSA-N
SMILES:
Cc1csc2n1nc(n2)c1ccccc1
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.274g/mol
Monoisotopic Mass:
215.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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