6-(2H-1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-(2H-1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C18H14N4O3S

SMILES: COC1=CC=C(CC2=NN=C3SC(=NN23)C2=CC=C3OCOC3=C2)C=C1

IUPAC: 6-(2H-1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C18H14N4O3S/c1-23-13-5-2-11(3-6-13)8-16-19-20-18-22(16)21-17(26-18)12-4-7-14-15(9-12)25-10-24-14/h2-7,9H,8,10H2,1H3

Composition: C (59.01%), H (3.85%), N (15.29%), O (13.10%), S (8.75%)

Molar Mass: 366.4

Atom Count: 40

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	366.078661501
Formal Charge	0
FSP3	0.17
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	AZFOHRHAZAJRJE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	128.32
Topological Polar Surface Area	70.77
Polarizability	36.87
Ring Count	5
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H14N4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00