5-bromo-N'-[(E)-[2-methyl-4-(piperidin-1-yl)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

5-bromo-N'-[(E)-[2-methyl-4-(piperidin-1-yl)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

Formula: C22H22BrN3O2

SMILES: CC1=CC(=CC=C1C=NNC(=O)C1=CC2=CC(Br)=CC=C2O1)N1CCCCC1

IUPAC: 5-bromo-N'-[(E)-[2-methyl-4-(piperidin-1-yl)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

InChI: InChI=1S/C22H22BrN3O2/c1-15-11-19(26-9-3-2-4-10-26)7-5-16(15)14-24-25-22(27)21-13-17-12-18(23)6-8-20(17)28-21/h5-8,11-14H,2-4,9-10H2,1H3,(H,25,27)/b24-14+

Composition: C (60.01%), H (5.04%), Br (18.15%), N (9.54%), O (7.27%)

Molar Mass: 440.341

Atom Count: 50

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	439.08954
Formal Charge	0
FSP3	0.27
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ACGNYMNMKPFWAP-ZVHZXABRSA-N
Lipinski's Rule of Five
Molar Refractivity	116.19
Topological Polar Surface Area	57.84
Polarizability	43.77
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H22BrN3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00