3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide
Compound characteristics
| Compound ID: | S233-2227 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}propanamide |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C20 H32 N4 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCOC)=O)CNC(CCn1c(C)cc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4352 |
| logD: | 0.4351 |
| logSw: | -1.3146 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.308 |
| InChI Key: | GZCAFSJOVDBLES-XLIONFOSSA-N |