OUL232

CAT: 0127-BUP03749-03Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP03749-03Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

943119-42-4

Purity

=98%

Smiles

N=1N=C(N)N2C1SC=3C(OC)=CC=C(OC)C32

Chemical Information

5,8-Dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-amine

CAS Number	943119-42-4
PubChem CID	2771058
IUPAC Name	5,8-dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-amine
Molecular Formula	C10H10N4O2S
Molecular Weight	250.28
XLogP	2.3
Topological Polar Surface Area	103
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	295

SMILES

COC1=C2C(=C(C=C1)OC)SC3=NN=C(N23)N

InChI

InChI=1S/C10H10N4O2S/c1-15-5-3-4-6(16-2)8-7(5)14-9(11)12-13-10(14)17-8/h3-4H,1-2H3,(H2,11,12)

InChIKey

FSNNMBVVDWKKCB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 943119-42-4

CID: 2771058

Formula: C10H10N4O2S

MW: 250.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	250.28
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Exact Mass	250.05244675
Monoisotopic Mass	250.05244675
Topological Polar Surface Area	103 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	295
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BUP15602-01	OUL35

Catalog	Name
BA4374-5.1	OUL232