N'-[(E)-{3-[2-(3-bromophenyl)hydrazin-1-ylidene]-6-oxocyclohexa-1,4-dien-1-yl}methylidene]-2-[(2,6-dimethylphenyl)amino]acetohydrazide

N'-[(E)-{3-[2-(3-bromophenyl)hydrazin-1-ylidene]-6-oxocyclohexa-1,4-dien-1-yl}methylidene]-2-[(2,6-dimethylphenyl)amino]acetohydrazide

Formula: C23H22BrN5O2

SMILES: CC1=CC=CC(C)=C1NCC(=O)NN=CC1=CC(C=CC1=O)=NNC1=CC=CC(Br)=C1

IUPAC: N'-[(E)-{3-[2-(3-bromophenyl)hydrazin-1-ylidene]-6-oxocyclohexa-1,4-dien-1-yl}methylidene]-2-[(2,6-dimethylphenyl)amino]acetohydrazide

InChI: InChI=1S/C23H22BrN5O2/c1-15-5-3-6-16(2)23(15)25-14-22(31)29-26-13-17-11-20(9-10-21(17)30)28-27-19-8-4-7-18(24)12-19/h3-13,25,27H,14H2,1-2H3,(H,29,31)/b26-13+,28-20?

Composition: C (57.51%), H (4.62%), Br (16.63%), N (14.58%), O (6.66%)

Molar Mass: 480.366

Atom Count: 53

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	479.095688
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	JJLAGTZUGZSLRW-YGXGCXDWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	130.24
Topological Polar Surface Area	94.95
Polarizability	46.56
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H22BrN5O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00