5-chloro-2-fluoro-N-{[rel-(4aR,7aS)-1-methyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzamide
Chemical Structure Depiction of
5-chloro-2-fluoro-N-{[rel-(4aR,7aS)-1-methyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzamide
5-chloro-2-fluoro-N-{[rel-(4aR,7aS)-1-methyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzamide
Compound characteristics
| Compound ID: | S233-0050 |
| Compound Name: | 5-chloro-2-fluoro-N-{[rel-(4aR,7aS)-1-methyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzamide |
| Molecular Weight: | 338.81 |
| Molecular Formula: | C17 H20 Cl F N2 O2 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2C)=O)CNC(c1cc(ccc1F)[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7222 |
| logD: | 2.7221 |
| logSw: | -3.6805 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.981 |
| InChI Key: | ARFMBALUDWWKTE-PBHICJAKSA-N |