N'-[(E)-(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-5-nitro-1-benzofuran-2-carbohydrazide

N'-[(E)-(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-5-nitro-1-benzofuran-2-carbohydrazide

Formula: C19H16ClN3O6

SMILES: CCOC1=C(Cl)C=C(C=NNC(=O)C2=CC3=CC(=CC=C3O2)[N+]([O-])=O)C=C1OC

IUPAC: N'-[(E)-(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-5-nitro-1-benzofuran-2-carbohydrazide

InChI: InChI=1S/C19H16ClN3O6/c1-3-28-18-14(20)6-11(7-16(18)27-2)10-21-22-19(24)17-9-12-8-13(23(25)26)4-5-15(12)29-17/h4-10H,3H2,1-2H3,(H,22,24)/b21-10+

Composition: C (54.62%), H (3.86%), Cl (8.48%), N (10.06%), O (22.98%)

Molar Mass: 417.8

Atom Count: 45

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	417.0727629
Formal Charge	0
FSP3	0.16
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	KBXMAZKZVSEBKC-UFFVCSGVSA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.75
Topological Polar Surface Area	116.2
Polarizability	40.43
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H16ClN3O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00