(2E)-2-cyano-N-cyclohexyl-3-(4-methoxy-3-nitrophenyl)prop-2-enamide

(2E)-2-cyano-N-cyclohexyl-3-(4-methoxy-3-nitrophenyl)prop-2-enamide

Formula: C17H19N3O4

SMILES: COC1=CC=C(C=C(/C#N)C(=O)NC2CCCCC2)C=C1[N+]([O-])=O

IUPAC: (2E)-2-cyano-N-cyclohexyl-3-(4-methoxy-3-nitrophenyl)prop-2-enamide

InChI: InChI=1S/C17H19N3O4/c1-24-16-8-7-12(10-15(16)20(22)23)9-13(11-18)17(21)19-14-5-3-2-4-6-14/h7-10,14H,2-6H2,1H3,(H,19,21)/b13-9+

Composition: C (62.00%), H (5.81%), N (12.76%), O (19.43%)

Molar Mass: 329.356

Atom Count: 43

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	329.137556104
Formal Charge	0
FSP3	0.41
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XLSVOMAXWSPVQT-UKTHLTGXSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.63
Topological Polar Surface Area	105.26
Polarizability	33.24
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H19N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00