2-{[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide

2-{[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide

Formula: C18H14F3N3O3S

SMILES: FC(F)(F)C1=CC(NC(=O)CSC2=NN=C(COC3=CC=CC=C3)O2)=CC=C1

IUPAC: 2-{[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide

InChI: InChI=1S/C18H14F3N3O3S/c19-18(20,21)12-5-4-6-13(9-12)22-15(25)11-28-17-24-23-16(27-17)10-26-14-7-2-1-3-8-14/h1-9H,10-11H2,(H,22,25)

Composition: C (52.81%), H (3.45%), F (13.92%), N (10.26%), O (11.72%), S (7.83%)

Molar Mass: 409.38

Atom Count: 42

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	409.070796986
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	GJDAHUUAQLPXLE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.1
Topological Polar Surface Area	77.25
Polarizability	36.3
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H14F3N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00