(2E)-2-cyano-N-(4-methyl-2-nitrophenyl)-3-(3-phenoxyphenyl)prop-2-enamide

(2E)-2-cyano-N-(4-methyl-2-nitrophenyl)-3-(3-phenoxyphenyl)prop-2-enamide

Formula: C23H17N3O4

SMILES: CC1=CC=C(NC(=O)C(=CC2=CC=CC(OC3=CC=CC=C3)=C2)C#N)C(=C1)[N+]([O-])=O

IUPAC: (2E)-2-cyano-N-(4-methyl-2-nitrophenyl)-3-(3-phenoxyphenyl)prop-2-enamide

InChI: InChI=1S/C23H17N3O4/c1-16-10-11-21(22(12-16)26(28)29)25-23(27)18(15-24)13-17-6-5-9-20(14-17)30-19-7-3-2-4-8-19/h2-14H,1H3,(H,25,27)/b18-13+

Composition: C (69.17%), H (4.29%), N (10.52%), O (16.02%)

Molar Mass: 399.406

Atom Count: 47

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	399.121906039
Formal Charge	0
FSP3	0.04
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	KUXIHYSCXWUIQD-QGOAFFKASA-N
Lipinski's Rule of Five
Molar Refractivity	113.99
Topological Polar Surface Area	105.26
Polarizability	42.03
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H17N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00