AC1LQ12J
2,4-dichloro-N-[[4-ethyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: 2,4-dichloro-N-({4-ethyl-5-[(2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide|2,4-dichloro-N-[[4-ethyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
CAS: 694516-16-0
| Molecular Formula | C23H25Cl2N5O2S |
|---|---|
| Molecular Weight | 505.1106 g/mol |
| LogP | 5.389 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 505.1106 |
| Monoisotopic Mass | 505.1106 |
| Heavy Atoms | 33 |
| Complexity | 1132.3805 |
Chemical Identifiers
| CAS Number | 694516-16-0 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(C)C)CNC(=O)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
AC1LQ12J (CAS 694516-16-0), with molecular formula C23H25Cl2N5O2S and molecular weight 505.1106 g/mol. IUPAC: 2,4-dichloro-N-[[4-ethyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide.
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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