1-(4-methylphenyl)-1-oxopropan-2-yl 2-(4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}phenyl)-8-methylquinoline-4-carboxylate

1-(4-methylphenyl)-1-oxopropan-2-yl 2-(4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}phenyl)-8-methylquinoline-4-carboxylate

Formula: C36H30N2O5

SMILES: CC(OC(=O)C1=CC(=NC2=C(C)C=CC=C12)C1=CC=C(C=C1)N1C(=O)C2C3CC(C=C3)C2C1=O)C(=O)C1=CC=C(C)C=C1

IUPAC: 1-(4-methylphenyl)-1-oxopropan-2-yl 2-(4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}phenyl)-8-methylquinoline-4-carboxylate

InChI: InChI=1/C36H30N2O5/c1-19-7-9-23(10-8-19)33(39)21(3)43-36(42)28-18-29(37-32-20(2)5-4-6-27(28)32)22-13-15-26(16-14-22)38-34(40)30-24-11-12-25(17-24)31(30)35(38)41/h4-16,18,21,24-25,30-31H,17H2,1-3H3

Composition: C (75.77%), H (5.30%), N (4.91%), O (14.02%)

Molar Mass: 570.645

Atom Count: 73

Heavy Atom Count: 43

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	5
Exact Mass	570.215472074
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	FFPXWOAYICCVNJ-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	162.5
Topological Polar Surface Area	93.64
Polarizability	64.61
Ring Count	7
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C36H30N2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00