AC1MGTGK
methyl 4-[[2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: methyl 4-(2-((4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|Methyl 4-[[2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate|methyl 4-({[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
CAS: 693229-89-9
| Molecular Formula | C24H26N4O3S |
|---|---|
| Molecular Weight | 450.17258 g/mol |
| LogP | 4.9677 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.17258 |
| Monoisotopic Mass | 450.17258 |
| Heavy Atoms | 32 |
| Complexity | 1060.6082 |
Chemical Identifiers
| CAS Number | 693229-89-9 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4 |
Product Overview
AC1MGTGK (CAS 693229-89-9), with molecular formula C24H26N4O3S and molecular weight 450.17258 g/mol. IUPAC: methyl 4-[[2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate.
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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