(2E)-2-cyano-N-(3,4-dichlorophenyl)-3-(4-ethoxy-3-iodophenyl)prop-2-enamide

(2E)-2-cyano-N-(3,4-dichlorophenyl)-3-(4-ethoxy-3-iodophenyl)prop-2-enamide

Formula: C18H13Cl2IN2O2

SMILES: CCOC1=CC=C(C=C(/C#N)C(=O)NC2=CC=C(Cl)C(Cl)=C2)C=C1I

IUPAC: (2E)-2-cyano-N-(3,4-dichlorophenyl)-3-(4-ethoxy-3-iodophenyl)prop-2-enamide

InChI: InChI=1S/C18H13Cl2IN2O2/c1-2-25-17-6-3-11(8-16(17)21)7-12(10-22)18(24)23-13-4-5-14(19)15(20)9-13/h3-9H,2H2,1H3,(H,23,24)/b12-7+

Composition: C (44.38%), H (2.69%), Cl (14.55%), I (26.05%), N (5.75%), O (6.57%)

Molar Mass: 487.12

Atom Count: 38

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	485.93988
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YFIJDGATMNOZFC-KPKJPENVSA-N
Lipinski's Rule of Five
Molar Refractivity	110.57
Topological Polar Surface Area	62.12
Polarizability	41.43
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H13Cl2IN2O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00