AC1MU72Y
ethyl N-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-cyanoprop-2-enoyl]carbamate
Also Known As: KS-00003FLA|ethyl N-(3-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-cyanoacryloyl)carbamate|ethyl N-[3-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-cyanoprop-2-enoyl]carbamate
CAS: 338979-07-0
| Molecular Formula | C17H17ClF3N5O3 |
|---|---|
| Molecular Weight | 431.0972 g/mol |
| LogP | 2.55598 |
| Topological Polar Surface Area | 98.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.0972 |
| Monoisotopic Mass | 431.0972 |
| Heavy Atoms | 29 |
| Complexity | 845.69574 |
Chemical Identifiers
| CAS Number | 338979-07-0 |
|---|---|
| SMILES | CCOC(=O)NC(=O)C(=CN1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl)C#N |
Product Overview
AC1MU72Y (CAS 338979-07-0), with molecular formula C17H17ClF3N5O3 and molecular weight 431.0972 g/mol. IUPAC: ethyl N-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-cyanoprop-2-enoyl]carbamate.
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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