methyl N-acetyl-3,3,3-trifluoro-2-{[(oxolan-2-yl)methyl]amino}alaninate
Chemical Structure Depiction of
methyl N-acetyl-3,3,3-trifluoro-2-{[(oxolan-2-yl)methyl]amino}alaninate
methyl N-acetyl-3,3,3-trifluoro-2-{[(oxolan-2-yl)methyl]amino}alaninate
Compound characteristics
| Compound ID: | 8014-1342 |
| Compound Name: | methyl N-acetyl-3,3,3-trifluoro-2-{[(oxolan-2-yl)methyl]amino}alaninate |
| Molecular Weight: | 298.26 |
| Molecular Formula: | C11 H17 F3 N2 O4 |
| Smiles: | CC(NC(C(=O)OC)(C(F)(F)F)NCC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.3596 |
| logD: | 0.3412 |
| logSw: | -1.1012 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.848 |
| InChI Key: | AEVAGMQDQDFUJV-UHFFFAOYSA-N |