AC1LPMC0
N-[[5-[2-(4-bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide
Also Known As: N-[[5-[2-(4-bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide|N-{[5-({2-[(4-bromo-2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzamide
CAS: 713097-33-7
| Molecular Formula | C22H23BrClN5O2S |
|---|---|
| Molecular Weight | 535.04443 g/mol |
| LogP | 4.99154 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.04443 |
| Monoisotopic Mass | 535.04443 |
| Heavy Atoms | 32 |
| Complexity | 1134.095 |
Chemical Identifiers
| CAS Number | 713097-33-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C(=C(C=C2)Br)C)C)CNC(=O)C3=CC=C(C=C3)Cl |
Product Overview
AC1LPMC0 (CAS 713097-33-7), with molecular formula C22H23BrClN5O2S and molecular weight 535.04443 g/mol. IUPAC: N-[[5-[2-(4-bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide.
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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