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2-(benzylsulfanyl)-N-(pyridin-3-yl)propanamide

2-(benzylsulfanyl)-N-(pyridin-3-yl)propanamide

Formula: C15H16N2OS

SMILES: CC(SCC1=CC=CC=C1)C(=O)NC1=CC=CN=C1

IUPAC: 2-(benzylsulfanyl)-N-(pyridin-3-yl)propanamide

InChI: InChI=1/C15H16N2OS/c1-12(19-11-13-6-3-2-4-7-13)15(18)17-14-8-5-9-16-10-14/h2-10,12H,11H2,1H3,(H,17,18)

Composition: C (66.15%), H (5.92%), N (10.29%), O (5.87%), S (11.77%)

Molar Mass: 272.37

Atom Count: 35

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 272.098334317
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XPFQMMIGNIROEX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.4
Topological Polar Surface Area 41.99
Polarizability 30.66
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H16N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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