N-[(4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)methyl]pentanamide

N-[(4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)methyl]pentanamide

Formula: C16H19N5OS

SMILES: CCCCC(=O)NCC1=CC=C(C=C1)C1=NN2C(C)=NN=C2S1

IUPAC: N-[(4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)methyl]pentanamide

InChI: InChI=1S/C16H19N5OS/c1-3-4-5-14(22)17-10-12-6-8-13(9-7-12)15-20-21-11(2)18-19-16(21)23-15/h6-9H,3-5,10H2,1-2H3,(H,17,22)

Composition: C (58.34%), H (5.81%), N (21.26%), O (4.86%), S (9.73%)

Molar Mass: 329.42

Atom Count: 42

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	329.131031426
Formal Charge	0
FSP3	0.37
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	QLCSYNAVSCWJPZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	123.11
Topological Polar Surface Area	72.18
Polarizability	34.53
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H19N5OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00