N'-[(2E,3E)-4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]-3,4,5-trimethoxybenzohydrazide

N'-[(2E,3E)-4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]-3,4,5-trimethoxybenzohydrazide

Formula: C21H22N2O6

SMILES: COC1=CC(=CC(OC)=C1OC)C(=O)NN=C(/C)C=CC1=CC=C2OCOC2=C1

IUPAC: N'-[(2E,3E)-4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]-3,4,5-trimethoxybenzohydrazide

InChI: InChI=1S/C21H22N2O6/c1-13(5-6-14-7-8-16-17(9-14)29-12-28-16)22-23-21(24)15-10-18(25-2)20(27-4)19(11-15)26-3/h5-11H,12H2,1-4H3,(H,23,24)/b6-5+,22-13+

Composition: C (63.31%), H (5.57%), N (7.03%), O (24.09%)

Molar Mass: 398.415

Atom Count: 51

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	398.147786436
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	JBSMKTSMSYSEQS-MHORGHPUSA-N
Lipinski's Rule of Five	1
Molar Refractivity	107.36
Topological Polar Surface Area	87.61
Polarizability	40.66
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H22N2O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00