(2E)-N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enamide

(2E)-N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enamide

Formula: C22H16ClN3O4

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

IUPAC: (2E)-N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enamide

InChI: InChI=1S/C22H16ClN3O4/c1-13-4-3-5-19(23)21(13)25-22(27)15(12-24)11-17-7-9-20(30-17)18-8-6-16(26(28)29)10-14(18)2/h3-11H,1-2H3,(H,25,27)/b15-11+

Composition: C (62.64%), H (3.82%), Cl (8.40%), N (9.96%), O (15.17%)

Molar Mass: 421.84

Atom Count: 46

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	421.0829337
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	KEIGCYGMZRGZGC-RVDMUPIBSA-N
Lipinski's Rule of Five
Molar Refractivity	115
Topological Polar Surface Area	109.17
Polarizability	43.18
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H16ClN3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00