4-[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyridine

4-[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyridine

Formula: C16H13N5O2S

SMILES: COC1=CC=C(C=C1OC)C1=NN=C2SC(=NN12)C1=CC=NC=C1

IUPAC: 4-[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyridine

InChI: InChI=1S/C16H13N5O2S/c1-22-12-4-3-11(9-13(12)23-2)14-18-19-16-21(14)20-15(24-16)10-5-7-17-8-6-10/h3-9H,1-2H3

Composition: C (56.63%), H (3.86%), N (20.64%), O (9.43%), S (9.45%)

Molar Mass: 339.37

Atom Count: 37

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	339.078995853
Formal Charge	0
FSP3	0.12
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	JBMPRIPJQCLBHD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	132.8
Topological Polar Surface Area	74.43
Polarizability	34.93
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H13N5O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00