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3-{3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pyridine

3-{3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pyridine

Formula: C14H15N5S

SMILES: C1CCC(CC1)C1=NN=C2SC(=NN12)C1=CC=CN=C1

IUPAC: 3-{3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pyridine

InChI: InChI=1S/C14H15N5S/c1-2-5-10(6-3-1)12-16-17-14-19(12)18-13(20-14)11-7-4-8-15-9-11/h4,7-10H,1-3,5-6H2

Composition: C (58.93%), H (5.30%), N (24.54%), S (11.23%)

Molar Mass: 285.37

Atom Count: 35

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 285.104816677
Formal Charge 0
FSP3 0.43
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey VRIMHNINSFTFSL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.41
Topological Polar Surface Area 55.97
Polarizability 29.86
Ring Count 4
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H15N5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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