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6-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C18H16N4O2S

SMILES: CCOC1=CC=C(C=C1)C1=NN2C(S1)=NN=C2C1=CC=C(OC)C=C1

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

InChI: InChI=1S/C18H16N4O2S/c1-3-24-15-10-6-13(7-11-15)17-21-22-16(19-20-18(22)25-17)12-4-8-14(23-2)9-5-12/h4-11H,3H2,1-2H3

Composition: C (61.35%), H (4.58%), N (15.90%), O (9.08%), S (9.10%)

Molar Mass: 352.41

Atom Count: 41

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 352.099396945
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey VZMNXENJPGCSNA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 139.7
Topological Polar Surface Area 61.54
Polarizability 37.65
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 C18H16N4O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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