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1-{1-[(3-phenoxyphenyl)methyl]piperidin-4-yl}-4-phenylpiperazine

1-{1-[(3-phenoxyphenyl)methyl]piperidin-4-yl}-4-phenylpiperazine

Formula: C28H33N3O

SMILES: C(N1CCC(CC1)N1CCN(CC1)C1=CC=CC=C1)C1=CC(OC2=CC=CC=C2)=CC=C1

IUPAC: 1-{1-[(3-phenoxyphenyl)methyl]piperidin-4-yl}-4-phenylpiperazine

InChI: InChI=1S/C28H33N3O/c1-3-9-25(10-4-1)30-18-20-31(21-19-30)26-14-16-29(17-15-26)23-24-8-7-13-28(22-24)32-27-11-5-2-6-12-27/h1-13,22,26H,14-21,23H2

Composition: C (78.65%), H (7.78%), N (9.83%), O (3.74%)

Molar Mass: 427.592

Atom Count: 65

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 427.262362695
Formal Charge 0
FSP3 0.36
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey ZBSGVXKIIFBCSW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 132.84
Topological Polar Surface Area 18.95
Polarizability 51.48
Ring Count 5
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C28H33N3O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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