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

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

Formula: C11H18N4OS

SMILES: CC1=NC(SCC(=O)NC2CCCCC2)=NN1

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

InChI: InChI=1S/C11H18N4OS/c1-8-12-11(15-14-8)17-7-10(16)13-9-5-3-2-4-6-9/h9H,2-7H2,1H3,(H,13,16)(H,12,14,15)

Composition: C (51.94%), H (7.13%), N (22.03%), O (6.29%), S (12.60%)

Molar Mass: 254.35

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 254.12013239
Formal Charge 0
FSP3 0.73
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey YUTRRHCDCACWTJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.03
Topological Polar Surface Area 70.67
Polarizability 26.34
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H18N4OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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