3-(2-methylfuran-3-yl)-6-(2-phenylethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

3-(2-methylfuran-3-yl)-6-(2-phenylethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C16H14N4OS

SMILES: CC1=C(C=CO1)C1=NN=C2SC(CCC3=CC=CC=C3)=NN12

IUPAC: 3-(2-methylfuran-3-yl)-6-(2-phenylethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C16H14N4OS/c1-11-13(9-10-21-11)15-17-18-16-20(15)19-14(22-16)8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3

Composition: C (61.92%), H (4.55%), N (18.05%), O (5.15%), S (10.33%)

Molar Mass: 310.38

Atom Count: 36

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	310.088832261
Formal Charge	0
FSP3	0.19
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ZHNXHWKPXABTRK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	118.35
Topological Polar Surface Area	56.22
Polarizability	32.27
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H14N4OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00