{[6-(4-cyanophenoxy)pyridin-3-yl]methylidene}amino 2,4-dichlorobenzoate

{[6-(4-cyanophenoxy)pyridin-3-yl]methylidene}amino 2,4-dichlorobenzoate

CAS: 339014-84-5

Formula: C20H11Cl2N3O3

SMILES: ClC1=CC(Cl)=C(C=C1)C(=O)ON=CC1=CN=C(OC2=CC=C(C=C2)C#N)C=C1

IUPAC: {[6-(4-cyanophenoxy)pyridin-3-yl]methylidene}amino 2,4-dichlorobenzoate

InChI: InChI=1S/C20H11Cl2N3O3/c21-15-4-7-17(18(22)9-15)20(26)28-25-12-14-3-8-19(24-11-14)27-16-5-1-13(10-23)2-6-16/h1-9,11-12H

Composition: C (58.27%), H (2.69%), Cl (17.20%), N (10.19%), O (11.64%)

Molar Mass: 412.23

Atom Count: 39

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	411.0177466
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	FRAYPVAABOJWTH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	106.01
Topological Polar Surface Area	84.57
Polarizability	40.14
Ring Count	3
Rotatable Bond Count	6

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90%	<2 Days	339014-84-5		$51.35-$86.31$51.35$63.37$86.31