5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,2-oxazole-3-carboxamide
5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | S233-1828 |
| Compound Name: | 5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C23 H33 N5 O4 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCOC)=O)CNC(c1cc(c2c(C)nn(CC)c2C)on1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4427 |
| logD: | 1.4427 |
| logSw: | -1.8394 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.349 |
| InChI Key: | WAYUQGKUXHPGKR-XXBNENTESA-N |