2-oxo-2-phenylethyl 4-{5-[2-(3-nitrophenyl)-2-oxoethoxy]-5-oxopentanamido}benzoate

2-oxo-2-phenylethyl 4-{5-[2-(3-nitrophenyl)-2-oxoethoxy]-5-oxopentanamido}benzoate

Formula: C28H24N2O9

SMILES: [O-][N+](=O)C1=CC(=CC=C1)C(=O)COC(=O)CCCC(=O)NC1=CC=C(C=C1)C(=O)OCC(=O)C1=CC=CC=C1

IUPAC: 2-oxo-2-phenylethyl 4-{5-[2-(3-nitrophenyl)-2-oxoethoxy]-5-oxopentanamido}benzoate

InChI: InChI=1S/C28H24N2O9/c31-24(19-6-2-1-3-7-19)18-39-28(35)20-12-14-22(15-13-20)29-26(33)10-5-11-27(34)38-17-25(32)21-8-4-9-23(16-21)30(36)37/h1-4,6-9,12-16H,5,10-11,17-18H2,(H,29,33)

Composition: C (63.16%), H (4.54%), N (5.26%), O (27.04%)

Molar Mass: 532.505

Atom Count: 63

Heavy Atom Count: 39

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	532.148180361
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	AAABVAIOPBBVOS-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	139.33
Topological Polar Surface Area	158.98
Polarizability	52.69
Ring Count	3
Rotatable Bond Count	15

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H24N2O9		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00