DU 28412
methanesulfonic acid;2-phenoxy-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]acetamide
Also Known As: DU 28412|Acetamide, 2-phenoxy-N-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, monomethanesulfonate|2-phenoxy-n-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)acetamide methanesulfonate(1:1)|methanesulfonicacid,2-phenoxy-N-[2-[4-[3- phenyl]piperazin-1-yl]ethyl]acetamide|methanesulfonic acid,2-phenoxy-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]acetamide|Methanesulfonic acid--2-phenoxy-N-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)acetamide (1/1)|methanesulfonic acid; 2-phenoxy-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]acetamide|methanesulfonic acid;2-phenoxy-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]acetamide
| Molecular Formula | C22H28F3N3O5S |
|---|---|
| Molecular Weight | 503.17017 g/mol |
| LogP | 2.5266 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 503.17017 |
| Monoisotopic Mass | 503.17017 |
| Heavy Atoms | 34 |
| Complexity | 596.0 |
Chemical Identifiers
| CAS Number | 86971-01-9 |
|---|---|
| SMILES | CS(=O)(=O)O.C1CN(CCN1CCNC(=O)COC2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F |
| InChIKey | FOIDXFCCCSNNOK-UHFFFAOYSA-N |
Product Overview
DU 28412 (CAS 86971-01-9), with molecular formula C22H28F3N3O5S and molecular weight 503.17017 g/mol. IUPAC: methanesulfonic acid;2-phenoxy-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]acetamide.
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