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1-{[3-(benzyloxy)-4-methoxyphenyl]methyl}-4-(pyridin-2-ylmethyl)piperazine

1-{[3-(benzyloxy)-4-methoxyphenyl]methyl}-4-(pyridin-2-ylmethyl)piperazine

Formula: C25H29N3O2

SMILES: COC1=CC=C(CN2CCN(CC3=CC=CC=N3)CC2)C=C1OCC1=CC=CC=C1

IUPAC: 1-{[3-(benzyloxy)-4-methoxyphenyl]methyl}-4-[(pyridin-2-yl)methyl]piperazine

InChI: InChI=1S/C25H29N3O2/c1-29-24-11-10-22(17-25(24)30-20-21-7-3-2-4-8-21)18-27-13-15-28(16-14-27)19-23-9-5-6-12-26-23/h2-12,17H,13-16,18-20H2,1H3

Composition: C (74.41%), H (7.24%), N (10.41%), O (7.93%)

Molar Mass: 403.526

Atom Count: 59

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 403.225977186
Formal Charge 0
FSP3 0.32
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey NFXXUEXJPLGWRW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 120.12
Topological Polar Surface Area 37.83
Polarizability 47.05
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H29N3O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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