N-{5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide

N-{5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide

Formula: C13H14FN3OS

SMILES: CC(C)C(=O)NC1=NN=C(CC2=CC=C(F)C=C2)S1

IUPAC: N-{5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide

InChI: InChI=1S/C13H14FN3OS/c1-8(2)12(18)15-13-17-16-11(19-13)7-9-3-5-10(14)6-4-9/h3-6,8H,7H2,1-2H3,(H,15,17,18)

Composition: C (55.90%), H (5.05%), F (6.80%), N (15.04%), O (5.73%), S (11.48%)

Molar Mass: 279.33

Atom Count: 33

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	279.08416142
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZACZSRXIFOSWMM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.31
Topological Polar Surface Area	54.88
Polarizability	26.91
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H14FN3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00