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

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

Formula: C18H14N4O2S2

SMILES: CC1=CC=C(C=C1)C1=NN=C(O1)SCC(=O)NC1=NC2=CC=CC=C2S1

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

InChI: InChI=1S/C18H14N4O2S2/c1-11-6-8-12(9-7-11)16-21-22-18(24-16)25-10-15(23)20-17-19-13-4-2-3-5-14(13)26-17/h2-9H,10H2,1H3,(H,19,20,23)

Composition: C (56.53%), H (3.69%), N (14.65%), O (8.37%), S (16.77%)

Molar Mass: 382.46

Atom Count: 40

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 382.055818055
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey AMPBHMUUBLWWEJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 114.41
Topological Polar Surface Area 80.91
Polarizability 40.35
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H14N4O2S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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