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1-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-chlorobenzoyl)piperazine

1-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-chlorobenzoyl)piperazine

Formula: C19H20BrClN2O2

SMILES: COC1=CC=C(Br)C=C1CN1CCN(CC1)C(=O)C1=CC=CC(Cl)=C1

IUPAC: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-chlorobenzoyl)piperazine

InChI: InChI=1S/C19H20BrClN2O2/c1-25-18-6-5-16(20)11-15(18)13-22-7-9-23(10-8-22)19(24)14-3-2-4-17(21)12-14/h2-6,11-12H,7-10,13H2,1H3

Composition: C (53.86%), H (4.76%), Br (18.86%), Cl (8.37%), N (6.61%), O (7.55%)

Molar Mass: 423.74

Atom Count: 45

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 422.039669
Formal Charge 0
FSP3 0.32
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey AGLDBEKPTLPYOU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.48
Topological Polar Surface Area 32.78
Polarizability 39.91
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H20BrClN2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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