(2E)-2-cyano-N-(3-iodophenyl)-3-(3-phenoxyphenyl)prop-2-enamide

(2E)-2-cyano-N-(3-iodophenyl)-3-(3-phenoxyphenyl)prop-2-enamide

Formula: C22H15IN2O2

SMILES: IC1=CC(NC(=O)C(=CC2=CC=CC(OC3=CC=CC=C3)=C2)C#N)=CC=C1

IUPAC: (2E)-2-cyano-N-(3-iodophenyl)-3-(3-phenoxyphenyl)prop-2-enamide

InChI: InChI=1S/C22H15IN2O2/c23-18-7-5-8-19(14-18)25-22(26)17(15-24)12-16-6-4-11-21(13-16)27-20-9-2-1-3-10-20/h1-14H,(H,25,26)/b17-12+

Composition: C (56.67%), H (3.24%), I (27.22%), N (6.01%), O (6.86%)

Molar Mass: 466.278

Atom Count: 42

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	466.01782
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	JGRPSFBGYLTKCX-SFQUDFHCSA-N
Lipinski's Rule of Five
Molar Refractivity	115.99
Topological Polar Surface Area	62.12
Polarizability	43.39
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H15IN2O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00