2-(3-fluorophenyl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide
Chemical Structure Depiction of
2-(3-fluorophenyl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide
2-(3-fluorophenyl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide
Compound characteristics
| Compound ID: | S233-1763 |
| Compound Name: | 2-(3-fluorophenyl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide |
| Molecular Weight: | 362.44 |
| Molecular Formula: | C20 H27 F N2 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCOC)=O)CNC(Cc1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9239 |
| logD: | 1.9239 |
| logSw: | -2.3211 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.323 |
| InChI Key: | HSINIISXZYGKNR-XLIONFOSSA-N |