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furan-2-ylmethyl (2Z)-3-(2H-1,3-benzodioxol-5-yl)-2-[(4-tert-butylphenyl)formamido]prop-2-enoate

furan-2-ylmethyl (2Z)-3-(2H-1,3-benzodioxol-5-yl)-2-[(4-tert-butylphenyl)formamido]prop-2-enoate

Formula: C26H25NO6

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=C/C1=CC=C2OCOC2=C1)C(=O)OCC1=CC=CO1

IUPAC: (furan-2-yl)methyl (2Z)-3-(2H-1,3-benzodioxol-5-yl)-2-[(4-tert-butylphenyl)formamido]prop-2-enoate

InChI: InChI=1S/C26H25NO6/c1-26(2,3)19-9-7-18(8-10-19)24(28)27-21(25(29)31-15-20-5-4-12-30-20)13-17-6-11-22-23(14-17)33-16-32-22/h4-14H,15-16H2,1-3H3,(H,27,28)/b21-13-

Composition: C (69.79%), H (5.63%), N (3.13%), O (21.45%)

Molar Mass: 447.487

Atom Count: 58

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 447.168187529
Formal Charge 0
FSP3 0.23
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey FVQKYYSBHYITCH-BKUYFWCQSA-N
Lipinski's Rule of Five 1
Molar Refractivity 123
Topological Polar Surface Area 87
Polarizability 46.86
Ring Count 4
Rotatable Bond Count 8

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H25NO6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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