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

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

Formula: C20H16N4O4S

SMILES: COC1=CC(=CC(OC)=C1OC)C1=NN=C2SC(=NN12)C1=CC2=CC=CC=C2O1

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

InChI: InChI=1S/C20H16N4O4S/c1-25-14-9-12(10-15(26-2)17(14)27-3)18-21-22-20-24(18)23-19(29-20)16-8-11-6-4-5-7-13(11)28-16/h4-10H,1-3H3

Composition: C (58.82%), H (3.95%), N (13.72%), O (15.67%), S (7.85%)

Molar Mass: 408.43

Atom Count: 45

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	408.089226185
Formal Charge	0
FSP3	0.15
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	SALYXMNRBCZBPN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	150.14
Topological Polar Surface Area	83.91
Polarizability	42.75
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H16N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00