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methyl 2-(2-ethoxy-4-{[(4E)-1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}phenoxy)acetate

methyl 2-(2-ethoxy-4-{[(4E)-1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}phenoxy)acetate

Formula: C22H21FN2O6

SMILES: CCOC1=CC(C=C2NC(=O)N(CC3=CC=C(F)C=C3)C2=O)=CC=C1OCC(=O)OC

IUPAC: methyl 2-(2-ethoxy-4-{[(4E)-1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}phenoxy)acetate

InChI: InChI=1S/C22H21FN2O6/c1-3-30-19-11-15(6-9-18(19)31-13-20(26)29-2)10-17-21(27)25(22(28)24-17)12-14-4-7-16(23)8-5-14/h4-11H,3,12-13H2,1-2H3,(H,24,28)/b17-10+

Composition: C (61.68%), H (4.94%), F (4.43%), N (6.54%), O (22.41%)

Molar Mass: 428.416

Atom Count: 52

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 428.138364567
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey TUKRNUUNIZTFIF-LICLKQGHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 109.98
Topological Polar Surface Area 94.17
Polarizability 41.66
Ring Count 3
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H21FN2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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