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N-methyl-4-{6-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl}-1,3-thiazol-2-amine

N-methyl-4-{6-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl}-1,3-thiazol-2-amine

CAS: 187596-92-5

Formula: C9H9N5S2

SMILES: CNC1=NC(=CS1)C1=C(C)N2N=CN=C2S1

IUPAC: N-methyl-4-{6-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl}-1,3-thiazol-2-amine

InChI: InChI=1S/C9H9N5S2/c1-5-7(6-3-15-8(10-2)13-6)16-9-11-4-12-14(5)9/h3-4H,1-2H3,(H,10,13)

Composition: C (43.01%), H (3.61%), N (27.87%), S (25.51%)

Molar Mass: 251.33

Atom Count: 25

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 251.029937658
Formal Charge 0
FSP3 0.22
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey OUPKDNVFXLIUQZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.9
Topological Polar Surface Area 55.11
Polarizability 24.62
Ring Count 3
Rotatable Bond Count 2

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90% <2 Days 187596-92-5 $51.35-$86.31$51.35$63.37$86.31
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