2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-(pyridin-4-yl)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-(pyridin-4-yl)acetamide
2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-(pyridin-4-yl)acetamide
Compound characteristics
| Compound ID: | SC76-0596 |
| Compound Name: | 2-{rel-(1aR,7bR)-1a-[(4-fluorophenoxy)methyl]-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl}-N-(pyridin-4-yl)acetamide |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C24 H20 F N3 O3 |
| Smiles: | [H][C@]12C[C@]2(COc2ccc(cc2)F)C(N(CC(Nc2ccncc2)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2423 |
| logD: | 3.167 |
| logSw: | -3.2564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.398 |
| InChI Key: | RHENZCFMOGKOTF-HYBUGGRVSA-N |