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4-{[({3-methoxy-2-[(4-methylphenyl)methoxy]phenyl}methyl)amino]methyl}benzoic acid

4-{[({3-methoxy-2-[(4-methylphenyl)methoxy]phenyl}methyl)amino]methyl}benzoic acid

Formula: C24H25NO4

SMILES: COC1=CC=CC(CNCC2=CC=C(C=C2)C(O)=O)=C1OCC1=CC=C(C)C=C1

IUPAC: 4-{[({3-methoxy-2-[(4-methylphenyl)methoxy]phenyl}methyl)amino]methyl}benzoic acid

InChI: InChI=1S/C24H25NO4/c1-17-6-8-19(9-7-17)16-29-23-21(4-3-5-22(23)28-2)15-25-14-18-10-12-20(13-11-18)24(26)27/h3-13,25H,14-16H2,1-2H3,(H,26,27)

Composition: C (73.64%), H (6.44%), N (3.58%), O (16.35%)

Molar Mass: 391.467

Atom Count: 54

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 391.178358289
Formal Charge 0
FSP3 0.21
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey UOHVKMYNSHJROK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 113.75
Topological Polar Surface Area 67.79
Polarizability 43.84
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 C24H25NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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