3-(3-methoxyphenyl)-6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

3-(3-methoxyphenyl)-6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C16H12N4OS

SMILES: COC1=CC=CC(=C1)C1=NN=C2SC(=NN12)C1=CC=CC=C1

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

InChI: InChI=1S/C16H12N4OS/c1-21-13-9-5-8-12(10-13)14-17-18-16-20(14)19-15(22-16)11-6-3-2-4-7-11/h2-10H,1H3

Composition: C (62.32%), H (3.92%), N (18.17%), O (5.19%), S (10.40%)

Molar Mass: 308.36

Atom Count: 34

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	308.073182196
Formal Charge	0
FSP3	0.06
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	KMMJDTDSFGFQSC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	128.49
Topological Polar Surface Area	52.31
Polarizability	33.3
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H12N4OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00