2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Chemical Structure Depiction of
2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide
2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Compound characteristics
| Compound ID: | SC76-0641 |
| Compound Name: | 2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide |
| Molecular Weight: | 440.51 |
| Molecular Formula: | C25 H29 F N2 O4 |
| Smiles: | [H][C@]12C[C@]2(COc2ccc(cc2)F)C(N(CC(NCCCOC(C)C)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.0067 |
| logD: | 3.0067 |
| logSw: | -3.4077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.606 |
| InChI Key: | FTFFAHUTMAHRER-PXDATVDWSA-N |