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3-(4-benzylpiperidine-1-carbonyl)-1-[(4-chlorophenyl)methyl]piperidine

3-(4-benzylpiperidine-1-carbonyl)-1-[(4-chlorophenyl)methyl]piperidine

Formula: C25H31ClN2O

SMILES: ClC1=CC=C(CN2CCCC(C2)C(=O)N2CCC(CC3=CC=CC=C3)CC2)C=C1

IUPAC: 3-(4-benzylpiperidine-1-carbonyl)-1-[(4-chlorophenyl)methyl]piperidine

InChI: InChI=1/C25H31ClN2O/c26-24-10-8-22(9-11-24)18-27-14-4-7-23(19-27)25(29)28-15-12-21(13-16-28)17-20-5-2-1-3-6-20/h1-3,5-6,8-11,21,23H,4,7,12-19H2

Composition: C (73.06%), H (7.60%), Cl (8.63%), N (6.82%), O (3.89%)

Molar Mass: 410.99

Atom Count: 60

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 410.2124913
Formal Charge 0
FSP3 0.48
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey KBZQQDJSSIHXRV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 120.64
Topological Polar Surface Area 23.55
Polarizability 46.93
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H31ClN2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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