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1-[(4-bromophenyl)methyl]-4-(furan-2-ylmethyl)piperazine

1-[(4-bromophenyl)methyl]-4-(furan-2-ylmethyl)piperazine

Formula: C16H19BrN2O

SMILES: BrC1=CC=C(CN2CCN(CC3=CC=CO3)CC2)C=C1

IUPAC: 1-[(4-bromophenyl)methyl]-4-[(furan-2-yl)methyl]piperazine

InChI: InChI=1S/C16H19BrN2O/c17-15-5-3-14(4-6-15)12-18-7-9-19(10-8-18)13-16-2-1-11-20-16/h1-6,11H,7-10,12-13H2

Composition: C (57.32%), H (5.71%), Br (23.83%), N (8.36%), O (4.77%)

Molar Mass: 335.245

Atom Count: 39

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 334.068076
Formal Charge 0
FSP3 0.37
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WGIQPCUQNARILO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.28
Topological Polar Surface Area 19.62
Polarizability 32.85
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H19BrN2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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