3-[6-(4-tert-butylphenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]pyridine

3-[6-(4-tert-butylphenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]pyridine

Formula: C19H19N5OS

SMILES: CC(C)(C)C1=CC=C(OCC2=NN3C(S2)=NN=C3C2=CC=CN=C2)C=C1

IUPAC: 3-{6-[(4-tert-butylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}pyridine

InChI: InChI=1S/C19H19N5OS/c1-19(2,3)14-6-8-15(9-7-14)25-12-16-23-24-17(21-22-18(24)26-16)13-5-4-10-20-11-13/h4-11H,12H2,1-3H3

Composition: C (62.45%), H (5.24%), N (19.16%), O (4.38%), S (8.77%)

Molar Mass: 365.46

Atom Count: 45

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	365.131031426
Formal Charge	0
FSP3	0.26
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	URGUOPSROBEPRI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	133.84
Topological Polar Surface Area	65.2
Polarizability	39.01
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H19N5OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00