2-(4-methoxyphenyl)-2-oxoethyl 3-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}benzoate

2-(4-methoxyphenyl)-2-oxoethyl 3-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}benzoate

Formula: C25H21NO6

SMILES: COC1=CC=C(C=C1)C(=O)COC(=O)C1=CC=CC(=C1)N1C(=O)C2C3CC(C=C3)C2C1=O

IUPAC: 2-(4-methoxyphenyl)-2-oxoethyl 3-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}benzoate

InChI: InChI=1/C25H21NO6/c1-31-19-9-7-14(8-10-19)20(27)13-32-25(30)17-3-2-4-18(12-17)26-23(28)21-15-5-6-16(11-15)22(21)24(26)29/h2-10,12,15-16,21-22H,11,13H2,1H3

Composition: C (69.60%), H (4.91%), N (3.25%), O (22.25%)

Molar Mass: 431.444

Atom Count: 53

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	4
Exact Mass	431.1368874
Formal Charge	0
FSP3	0.28
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	FZAQNMOLWKREQE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.71
Topological Polar Surface Area	89.98
Polarizability	44.19
Ring Count	5
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H21NO6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00