AC1N5GFO
N-[[4-(2-chlorophenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide
Also Known As: F0528-1244|(1s,3s)-N-((4-(2-chlorophenyl)-5-(isopropylthio)-4H-1,2,4-triazol-3-yl)methyl)adamantane-1-carboxamide|N-[[4-(2-chlorophenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide|N-{[4-(2-chlorophenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}adamantane-1-carboxamide
CAS: 477302-16-2
| Molecular Formula | C23H29ClN4OS |
|---|---|
| Molecular Weight | 444.17505 g/mol |
| LogP | 5.2538 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.17505 |
| Monoisotopic Mass | 444.17505 |
| Heavy Atoms | 30 |
| Complexity | 921.14557 |
Chemical Identifiers
| CAS Number | 477302-16-2 |
|---|---|
| SMILES | CC(C)SC1=NN=C(N1C2=CC=CC=C2Cl)CNC(=O)C34CC5CC(C3)CC(C5)C4 |
Product Overview
AC1N5GFO (CAS 477302-16-2), with molecular formula C23H29ClN4OS and molecular weight 444.17505 g/mol. IUPAC: N-[[4-(2-chlorophenyl)-5-propan-2-ylsulfanyl-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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