2-(4-methylphenyl)-2-oxoethyl 6-bromo-8-methyl-2-phenylquinoline-4-carboxylate

2-(4-methylphenyl)-2-oxoethyl 6-bromo-8-methyl-2-phenylquinoline-4-carboxylate

Formula: C26H20BrNO3

SMILES: CC1=CC=C(C=C1)C(=O)COC(=O)C1=C2C=C(Br)C=C(C)C2=NC(=C1)C1=CC=CC=C1

IUPAC: 2-(4-methylphenyl)-2-oxoethyl 6-bromo-8-methyl-2-phenylquinoline-4-carboxylate

InChI: InChI=1S/C26H20BrNO3/c1-16-8-10-19(11-9-16)24(29)15-31-26(30)22-14-23(18-6-4-3-5-7-18)28-25-17(2)12-20(27)13-21(22)25/h3-14H,15H2,1-2H3

Composition: C (65.83%), H (4.25%), Br (16.84%), N (2.95%), O (10.12%)

Molar Mass: 474.354

Atom Count: 51

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	473.062657
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ZVNGDQOQGIRQQQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	124.38
Topological Polar Surface Area	56.26
Polarizability	49.98
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H20BrNO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00