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3,4,5-triethoxy-N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]benzamide

3,4,5-triethoxy-N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]benzamide

Formula: C28H30N2O5

SMILES: CCOC1=CC(=CC(OCC)=C1OCC)C(=O)NC1=CC=C2OC(=NC2=C1)C1=CC=C(CC)C=C1

IUPAC: 3,4,5-triethoxy-N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]benzamide

InChI: InChI=1S/C28H30N2O5/c1-5-18-9-11-19(12-10-18)28-30-22-17-21(13-14-23(22)35-28)29-27(31)20-15-24(32-6-2)26(34-8-4)25(16-20)33-7-3/h9-17H,5-8H2,1-4H3,(H,29,31)

Composition: C (70.87%), H (6.37%), N (5.90%), O (16.86%)

Molar Mass: 474.557

Atom Count: 65

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 474.215472074
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey RVGJELVAOBBOLW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 146.64
Topological Polar Surface Area 82.82
Polarizability 53.4
Ring Count 4
Rotatable Bond Count 10

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C28H30N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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