AC1N4CFX
N-[[5-butylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide
Also Known As: F0528-0997|N-[[5-butylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide|N-{[5-(butylsulfanyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]methyl}adamantane-1-carboxamide|(1S,3s)-N-((5-(butylthio)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)methyl)adamantane-1-carboxamide
CAS: 477299-66-4
| Molecular Formula | C25H34N4O2S |
|---|---|
| Molecular Weight | 454.24023 g/mol |
| LogP | 5.0007 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 454.24023 |
| Monoisotopic Mass | 454.24023 |
| Heavy Atoms | 32 |
| Complexity | 920.0673 |
Chemical Identifiers
| CAS Number | 477299-66-4 |
|---|---|
| SMILES | CCCCSC1=NN=C(N1C2=CC=C(C=C2)OC)CNC(=O)C34CC5CC(C3)CC(C5)C4 |
Product Overview
AC1N4CFX (CAS 477299-66-4), with molecular formula C25H34N4O2S and molecular weight 454.24023 g/mol. IUPAC: N-[[5-butylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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