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

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

Formula: C17H20BrN3

SMILES: BrC1=CC=CC=C1CN1CCN(CC2=CC=CC=N2)CC1

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

InChI: InChI=1S/C17H20BrN3/c18-17-7-2-1-5-15(17)13-20-9-11-21(12-10-20)14-16-6-3-4-8-19-16/h1-8H,9-14H2

Composition: C (58.97%), H (5.82%), Br (23.08%), N (12.14%)

Molar Mass: 346.272

Atom Count: 41

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 345.084061
Formal Charge 0
FSP3 0.35
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey WPQIMUQMZOLKSD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 90.21
Topological Polar Surface Area 19.37
Polarizability 35.06
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H20BrN3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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