AC1NQSQZ
N-[[5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,5,5-trimethylhexanamide
Also Known As: N-{[5-(Benzylsulfanyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}-3,5,5-trimethylhexanamide|N-[[5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,5,5-trimethyl-hexanamide|N-[[5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,5,5-trimethylhexanamide
CAS: 5977-74-2
| Molecular Formula | C26H34N4OS |
|---|---|
| Molecular Weight | 450.24533 g/mol |
| LogP | 5.94662 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.24533 |
| Monoisotopic Mass | 450.24533 |
| Heavy Atoms | 32 |
| Complexity | 1006.5562 |
Chemical Identifiers
| CAS Number | 5977-74-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)CNC(=O)CC(C)CC(C)(C)C |
Product Overview
AC1NQSQZ (CAS 5977-74-2), with molecular formula C26H34N4OS and molecular weight 450.24533 g/mol. IUPAC: N-[[5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,5,5-trimethylhexanamide.
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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