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(2E)-2-cyano-N-(furan-2-ylmethyl)-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}prop-2-enamide

(2E)-2-cyano-N-(furan-2-ylmethyl)-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}prop-2-enamide

Formula: C25H24N2O6

SMILES: COC1=CC=C(OCCOC2=CC=C(C=C(/C#N)C(=O)NCC3=CC=CO3)C=C2OC)C=C1

IUPAC: (2E)-2-cyano-N-[(furan-2-yl)methyl]-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}prop-2-enamide

InChI: InChI=1S/C25H24N2O6/c1-29-20-6-8-21(9-7-20)32-12-13-33-23-10-5-18(15-24(23)30-2)14-19(16-26)25(28)27-17-22-4-3-11-31-22/h3-11,14-15H,12-13,17H2,1-2H3,(H,27,28)/b19-14+

Composition: C (66.95%), H (5.39%), N (6.25%), O (21.40%)

Molar Mass: 448.475

Atom Count: 57

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 448.163436501
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey NDYVCSPEJJLGNF-XMHGGMMESA-N
Lipinski's Rule of Five 1
Molar Refractivity 121.78
Topological Polar Surface Area 102.95
Polarizability 46.49
Ring Count 3
Rotatable Bond Count 11

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H24N2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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