1,3-dimethyl-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1,3-dimethyl-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1H-pyrazole-5-carboxamide
1,3-dimethyl-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | S233-2066 |
| Compound Name: | 1,3-dimethyl-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 332.44 |
| Molecular Formula: | C18 H28 N4 O2 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCC)=O)CNC(c1cc(C)nn1C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2921 |
| logD: | 1.2921 |
| logSw: | -1.8626 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.516 |
| InChI Key: | ZSYAORGAYRBCCQ-QAPCUYQASA-N |