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2-{[5-(4-methylphenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide

2-{[5-(4-methylphenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide

Formula: C20H21N3O3S

SMILES: CC1=CC=C(OCC2=NN=C(O2)SCC(=O)NCCC2=CC=CC=C2)C=C1

IUPAC: 2-({5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide

InChI: InChI=1S/C20H21N3O3S/c1-15-7-9-17(10-8-15)25-13-19-22-23-20(26-19)27-14-18(24)21-12-11-16-5-3-2-4-6-16/h2-10H,11-14H2,1H3,(H,21,24)

Composition: C (62.64%), H (5.52%), N (10.96%), O (12.52%), S (8.36%)

Molar Mass: 383.47

Atom Count: 48

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 383.130362722
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey IECDULAVKYKJPH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 106.98
Topological Polar Surface Area 77.25
Polarizability 40.57
Ring Count 3
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H21N3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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