AC1NQKP7
2-[4-chloro-6-[4-(3,3-dimethylbutanoyl)-3-methylpiperazin-1-yl]pyrimidin-2-yl]sulfanyl-N,N-diethylacetamide
Also Known As: 2-({4-Chloro-6-[4-(3,3-dimethylbutanoyl)-3-methylpiperazin-1-yl]pyrimidin-2-yl}sulfanyl)-N,N-diethylacetamide|2-[4-chloro-6-[4-(3,3-dimethylbutanoyl)-3-methylpiperazin-1-yl]pyrimidin-2-yl]sulfanyl-N,N-diethylacetamide
CAS: 5899-97-8
| Molecular Formula | C21H34ClN5O2S |
|---|---|
| Molecular Weight | 455.2122 g/mol |
| LogP | 3.5638 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.2122 |
| Monoisotopic Mass | 455.2122 |
| Heavy Atoms | 30 |
| Complexity | 751.4025 |
Chemical Identifiers
| CAS Number | 5899-97-8 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=NC(=CC(=N1)Cl)N2CCN(C(C2)C)C(=O)CC(C)(C)C |
Product Overview
AC1NQKP7 (CAS 5899-97-8), with molecular formula C21H34ClN5O2S and molecular weight 455.2122 g/mol. IUPAC: 2-[4-chloro-6-[4-(3,3-dimethylbutanoyl)-3-methylpiperazin-1-yl]pyrimidin-2-yl]sulfanyl-N,N-diethylacetamide.
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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