4-{3-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pyridine

4-{3-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pyridine

Formula: C12H13N5S

SMILES: CCCCC1=NN=C2SC(=NN12)C1=CC=NC=C1

IUPAC: 4-{3-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pyridine

InChI: InChI=1S/C12H13N5S/c1-2-3-4-10-14-15-12-17(10)16-11(18-12)9-5-7-13-8-6-9/h5-8H,2-4H2,1H3

Composition: C (55.58%), H (5.05%), N (27.01%), S (12.36%)

Molar Mass: 259.33

Atom Count: 31

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	259.089166613
Formal Charge	0
FSP3	0.33
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	RVJBSSLPFOKUIF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.04
Topological Polar Surface Area	55.97
Polarizability	26.91
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H13N5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00