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

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

Formula: C25H23NO6

SMILES: COC1=CC=CC(=C1)C(=O)COC(=O)C1=CC=C(C=C1)N1C(=O)C2C3CCC(C3)C2C1=O

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

InChI: InChI=1/C25H23NO6/c1-31-19-4-2-3-15(12-19)20(27)13-32-25(30)14-7-9-18(10-8-14)26-23(28)21-16-5-6-17(11-16)22(21)24(26)29/h2-4,7-10,12,16-17,21-22H,5-6,11,13H2,1H3

Composition: C (69.27%), H (5.35%), N (3.23%), O (22.15%)

Molar Mass: 433.46

Atom Count: 55

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 4
Exact Mass 433.152537465
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey DGSJUHSUZFXHAL-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 114.59
Topological Polar Surface Area 89.98
Polarizability 44.44
Ring Count 5
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H23NO6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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