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2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide

2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide

Formula: C20H25N3O2S

SMILES: COC1=CC=CC=C1N1CCN(CC(=O)NC2=CC=CC(SC)=C2)CC1

IUPAC: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide

InChI: InChI=1S/C20H25N3O2S/c1-25-19-9-4-3-8-18(19)23-12-10-22(11-13-23)15-20(24)21-16-6-5-7-17(14-16)26-2/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)

Composition: C (64.66%), H (6.78%), N (11.31%), O (8.61%), S (8.63%)

Molar Mass: 371.5

Atom Count: 51

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 371.166748231
Formal Charge 0
FSP3 0.35
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey RGSUEQNNYUHUHG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.12
Topological Polar Surface Area 44.81
Polarizability 41.51
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H25N3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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