N-[5-({N'-[(E)-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

N-[5-({N'-[(E)-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

Formula: C21H14F3N5O4S

SMILES: FC(F)(F)C1=CC(=CC=C1)C1=CC=C(O1)C=NNC(=O)CC1=NN=C(NC(=O)C2=CC=CO2)S1

IUPAC: N-[5-({N'-[(E)-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene]hydrazinecarbonyl}methyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

InChI: InChI=1S/C21H14F3N5O4S/c22-21(23,24)13-4-1-3-12(9-13)15-7-6-14(33-15)11-25-27-17(30)10-18-28-29-20(34-18)26-19(31)16-5-2-8-32-16/h1-9,11H,10H2,(H,27,30)(H,26,29,31)/b25-11+

Composition: C (51.54%), H (2.88%), F (11.65%), N (14.31%), O (13.08%), S (6.55%)

Molar Mass: 489.43

Atom Count: 48

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	489.071859614
Formal Charge	0
FSP3	0.1
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	PKTXYLAPXGHLCV-OPEKNORGSA-N
Lipinski's Rule of Five	1
Molar Refractivity	117.87
Topological Polar Surface Area	122.62
Polarizability	42.89
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H14F3N5O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00