6-(2-ethoxyphenoxymethyl)-3-[(phenylsulfanyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-(2-ethoxyphenoxymethyl)-3-[(phenylsulfanyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C19H18N4O2S2

SMILES: CCOC1=CC=CC=C1OCC1=NN2C(CSC3=CC=CC=C3)=NN=C2S1

IUPAC: 6-[(2-ethoxyphenoxy)methyl]-3-[(phenylsulfanyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C19H18N4O2S2/c1-2-24-15-10-6-7-11-16(15)25-12-18-22-23-17(20-21-19(23)27-18)13-26-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3

Composition: C (57.27%), H (4.55%), N (14.06%), O (8.03%), S (16.09%)

Molar Mass: 398.5

Atom Count: 45

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	398.087118184
Formal Charge	0
FSP3	0.21
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	ZORLAJCUWLDRBR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	130.29
Topological Polar Surface Area	61.54
Polarizability	41.2
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H18N4O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00