ethyl 3-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]decan-4-yl}benzoate

ethyl 3-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]decan-4-yl}benzoate

Formula: C18H19NO4

SMILES: CCOC(=O)C1=CC=CC(=C1)N1C(=O)C2C3CCC(C3)C2C1=O

IUPAC: ethyl 3-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]decan-4-yl}benzoate

InChI: InChI=1/C18H19NO4/c1-2-23-18(22)12-4-3-5-13(9-12)19-16(20)14-10-6-7-11(8-10)15(14)17(19)21/h3-5,9-11,14-15H,2,6-8H2,1H3

Composition: C (69.00%), H (6.11%), N (4.47%), O (20.42%)

Molar Mass: 313.353

Atom Count: 42

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	313.131408096
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	OHYOZKDGSDBNPY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.97
Topological Polar Surface Area	63.68
Polarizability	32.27
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H19NO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00