6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C13H14N4O2S

SMILES: COC1=CC=C(CC2=NN3C(C)=NN=C3S2)C=C1OC

IUPAC: 6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C13H14N4O2S/c1-8-14-15-13-17(8)16-12(20-13)7-9-4-5-10(18-2)11(6-9)19-3/h4-6H,7H2,1-3H3

Composition: C (53.78%), H (4.86%), N (19.30%), O (11.02%), S (11.04%)

Molar Mass: 290.34

Atom Count: 34

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	290.083746881
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	DOYPYTYVJSILSI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.35
Topological Polar Surface Area	61.54
Polarizability	28.45
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H14N4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00