N'-benzyl-4-(2-chloro-4-nitrophenoxy)-N-methylbenzenecarboximidamide

N'-benzyl-4-(2-chloro-4-nitrophenoxy)-N-methylbenzenecarboximidamide

Formula: C21H18ClN3O3

SMILES: CNC(=NCC1=CC=CC=C1)C1=CC=C(OC2=CC=C(C=C2Cl)[N+]([O-])=O)C=C1

IUPAC: N'-benzyl-4-(2-chloro-4-nitrophenoxy)-N-methylbenzene-1-carboximidamide

InChI: InChI=1S/C21H18ClN3O3/c1-23-21(24-14-15-5-3-2-4-6-15)16-7-10-18(11-8-16)28-20-12-9-17(25(26)27)13-19(20)22/h2-13H,14H2,1H3,(H,23,24)

Composition: C (63.72%), H (4.58%), Cl (8.96%), N (10.62%), O (12.13%)

Molar Mass: 395.84

Atom Count: 46

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	395.1036692
Formal Charge	0
FSP3	0.1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	BIWUBVLCAYMEQX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	108.97
Topological Polar Surface Area	76.76
Polarizability	41.37
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H18ClN3O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00