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1-[(3-methylphenyl)methyl]-4-(pyridin-4-ylmethyl)piperazine

1-[(3-methylphenyl)methyl]-4-(pyridin-4-ylmethyl)piperazine

Formula: C18H23N3

SMILES: CC1=CC=CC(CN2CCN(CC3=CC=NC=C3)CC2)=C1

IUPAC: 1-[(3-methylphenyl)methyl]-4-[(pyridin-4-yl)methyl]piperazine

InChI: InChI=1S/C18H23N3/c1-16-3-2-4-18(13-16)15-21-11-9-20(10-12-21)14-17-5-7-19-8-6-17/h2-8,13H,9-12,14-15H2,1H3

Composition: C (76.83%), H (8.24%), N (14.93%)

Molar Mass: 281.403

Atom Count: 44

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 281.189197753
Formal Charge 0
FSP3 0.39
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey JATGIVNOAIPGEH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.15
Topological Polar Surface Area 19.37
Polarizability 34.21
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H23N3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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