6-(2H-1,3-benzodioxol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-(2H-1,3-benzodioxol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C10H6N4O2S

SMILES: C1OC2=C(O1)C=C(C=C2)C1=NN2C=NN=C2S1

IUPAC: 6-(2H-1,3-benzodioxol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C10H6N4O2S/c1-2-7-8(16-5-15-7)3-6(1)9-13-14-4-11-12-10(14)17-9/h1-4H,5H2

Composition: C (48.78%), H (2.46%), N (22.75%), O (12.99%), S (13.02%)

Molar Mass: 246.24

Atom Count: 23

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	246.021146623
Formal Charge	0
FSP3	0.1
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	GKWUILHSMWQFPC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.69
Topological Polar Surface Area	61.54
Polarizability	23.06
Ring Count	4
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C10H6N4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00