(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enamide

(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enamide

Formula: C22H13ClF3N3O4

SMILES: CC1=CC(=CC=C1C1=CC=C(O1)C=C(/C#N)C(=O)NC1=CC(=CC=C1Cl)C(F)(F)F)[N+]([O-])=O

IUPAC: (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enamide

InChI: InChI=1S/C22H13ClF3N3O4/c1-12-8-15(29(31)32)3-5-17(12)20-7-4-16(33-20)9-13(11-27)21(30)28-19-10-14(22(24,25)26)2-6-18(19)23/h2-10H,1H3,(H,28,30)/b13-9+

Composition: C (55.54%), H (2.75%), Cl (7.45%), F (11.98%), N (8.83%), O (13.45%)

Molar Mass: 475.81

Atom Count: 46

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	475.0546681
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DLXHLLWMXKDMDC-UKTHLTGXSA-N
Lipinski's Rule of Five
Molar Refractivity	115.94
Topological Polar Surface Area	109.17
Polarizability	42.58
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H13ClF3N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00