1-(4-methylphenyl)-1-oxopropan-2-yl 2-(4-bromophenyl)-8-methylquinoline-4-carboxylate

1-(4-methylphenyl)-1-oxopropan-2-yl 2-(4-bromophenyl)-8-methylquinoline-4-carboxylate

Formula: C27H22BrNO3

SMILES: CC(OC(=O)C1=CC(=NC2=C(C)C=CC=C12)C1=CC=C(Br)C=C1)C(=O)C1=CC=C(C)C=C1

IUPAC: 1-(4-methylphenyl)-1-oxopropan-2-yl 2-(4-bromophenyl)-8-methylquinoline-4-carboxylate

InChI: InChI=1/C27H22BrNO3/c1-16-7-9-20(10-8-16)26(30)18(3)32-27(31)23-15-24(19-11-13-21(28)14-12-19)29-25-17(2)5-4-6-22(23)25/h4-15,18H,1-3H3

Composition: C (66.40%), H (4.54%), Br (16.36%), N (2.87%), O (9.83%)

Molar Mass: 488.381

Atom Count: 54

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	487.078307
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	HIDVOQGDFRAOFW-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	128.87
Topological Polar Surface Area	56.26
Polarizability	51.82
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H22BrNO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00