(2Z)-3-{5-bromo-2-[(2-cyanophenyl)methoxy]phenyl}-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide

(2Z)-3-{5-bromo-2-[(2-cyanophenyl)methoxy]phenyl}-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide

Formula: C24H16BrN3O3

SMILES: OC1=CC=C(NC(=O)C(=C/C2=CC(Br)=CC=C2OCC2=CC=CC=C2C#N)C#N)C=C1

IUPAC: (2Z)-3-{5-bromo-2-[(2-cyanophenyl)methoxy]phenyl}-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide

InChI: InChI=1S/C24H16BrN3O3/c25-20-5-10-23(31-15-17-4-2-1-3-16(17)13-26)18(12-20)11-19(14-27)24(30)28-21-6-8-22(29)9-7-21/h1-12,29H,15H2,(H,28,30)/b19-11-

Composition: C (60.77%), H (3.40%), Br (16.85%), N (8.86%), O (10.12%)

Molar Mass: 474.314

Atom Count: 47

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	473.037504
Formal Charge	0
FSP3	0.04
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	KSIOPGOHYNHBDZ-ODLFYWEKSA-N
Lipinski's Rule of Five
Molar Refractivity	122.79
Topological Polar Surface Area	106.14
Polarizability	45.36
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H16BrN3O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00