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6-(diphenylmethyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-(diphenylmethyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C17H11F3N4S

SMILES: FC(F)(F)C1=NN=C2SC(=NN12)C(C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 6-(diphenylmethyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C17H11F3N4S/c18-17(19,20)15-21-22-16-24(15)23-14(25-16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H

Composition: C (56.66%), H (3.08%), F (15.82%), N (15.55%), S (8.90%)

Molar Mass: 360.36

Atom Count: 36

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 360.065652033
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey FPWPLECBWCHHLK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 111.11
Topological Polar Surface Area 43.08
Polarizability 32.3
Ring Count 4
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H11F3N4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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