2-(4-bromophenyl)-2-oxoethyl 4-{3,5-dioxo-8-phenyl-4-azatricyclo[5.2.1.0²,?]decan-4-yl}benzoate

2-(4-bromophenyl)-2-oxoethyl 4-{3,5-dioxo-8-phenyl-4-azatricyclo[5.2.1.0²,?]decan-4-yl}benzoate

Formula: C30H24BrNO5

SMILES: BrC1=CC=C(C=C1)C(=O)COC(=O)C1=CC=C(C=C1)N1C(=O)C2C3CC(C(C3)C3=CC=CC=C3)C2C1=O

IUPAC: 2-(4-bromophenyl)-2-oxoethyl 4-{3,5-dioxo-8-phenyl-4-azatricyclo[5.2.1.0²,?]decan-4-yl}benzoate

InChI: InChI=1/C30H24BrNO5/c31-21-10-6-18(7-11-21)25(33)16-37-30(36)19-8-12-22(13-9-19)32-28(34)26-20-14-23(17-4-2-1-3-5-17)24(15-20)27(26)29(32)35/h1-13,20,23-24,26-27H,14-16H2

Composition: C (64.53%), H (4.33%), Br (14.31%), N (2.51%), O (14.33%)

Molar Mass: 558.428

Atom Count: 61

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	5
Exact Mass	557.083786
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	XZPSXCCCZNOXPO-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	140.39
Topological Polar Surface Area	80.75
Polarizability	54.23
Ring Count	6
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C30H24BrNO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00