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2-(4-tert-butylphenoxy)-N-(4-{4-[2-(4-tert-butylphenoxy)acetamido]phenoxy}phenyl)acetamide

2-(4-tert-butylphenoxy)-N-(4-{4-[2-(4-tert-butylphenoxy)acetamido]phenoxy}phenyl)acetamide

Formula: C36H40N2O5

SMILES: CC(C)(C)C1=CC=C(OCC(=O)NC2=CC=C(OC3=CC=C(NC(=O)COC4=CC=C(C=C4)C(C)(C)C)C=C3)C=C2)C=C1

IUPAC: 2-(4-tert-butylphenoxy)-N-(4-{4-[2-(4-tert-butylphenoxy)acetamido]phenoxy}phenyl)acetamide

InChI: InChI=1S/C36H40N2O5/c1-35(2,3)25-7-15-29(16-8-25)41-23-33(39)37-27-11-19-31(20-12-27)43-32-21-13-28(14-22-32)38-34(40)24-42-30-17-9-26(10-18-30)36(4,5)6/h7-22H,23-24H2,1-6H3,(H,37,39)(H,38,40)

Composition: C (74.46%), H (6.94%), N (4.82%), O (13.78%)

Molar Mass: 580.725

Atom Count: 83

Heavy Atom Count: 43

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 580.293722396
Formal Charge 0
FSP3 0.28
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey KGSRBTGBXDCEML-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 171.28
Topological Polar Surface Area 85.89
Polarizability 65.54
Ring Count 4
Rotatable Bond Count 12

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C36H40N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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