methyl 3-acetamido-2-[N-(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)ethanimidoyl]-4,4,4-trifluoro-3-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 3-acetamido-2-[N-(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)ethanimidoyl]-4,4,4-trifluoro-3-(trifluoromethyl)butanoate
methyl 3-acetamido-2-[N-(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)ethanimidoyl]-4,4,4-trifluoro-3-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | 8019-1483 |
| Compound Name: | methyl 3-acetamido-2-[N-(2-acetamido-1,1,1,3,3,3-hexafluoropropan-2-yl)ethanimidoyl]-4,4,4-trifluoro-3-(trifluoromethyl)butanoate |
| Molecular Weight: | 529.28 |
| Molecular Formula: | C15 H15 F12 N3 O4 |
| Smiles: | C\C(C(C(=O)OC)C(C(F)(F)F)(C(F)(F)F)NC(C)=O)=N/C(C(F)(F)F)(C(F)(F)F)NC(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6792 |
| logD: | -2.1146 |
| logSw: | -2.8648 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.662 |
| InChI Key: | BBTKREHFJVOCBZ-QMMMGPOBSA-N |