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N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide

N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide

Formula: C13H17N5OS3

SMILES: CC1=NN=C(SCC(=O)NC2=NN=C(S2)C2CCCCC2)S1

IUPAC: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide

InChI: InChI=1S/C13H17N5OS3/c1-8-15-18-13(21-8)20-7-10(19)14-12-17-16-11(22-12)9-5-3-2-4-6-9/h9H,2-7H2,1H3,(H,14,17,19)

Composition: C (43.92%), H (4.82%), N (19.70%), O (4.50%), S (27.06%)

Molar Mass: 355.49

Atom Count: 39

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 355.059523709
Formal Charge 0
FSP3 0.62
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey BREBZPBQYBAKEU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.02
Topological Polar Surface Area 80.66
Polarizability 33.86
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H17N5OS3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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