2-(3-methyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide
Chemical Structure Depiction of
2-(3-methyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide
2-(3-methyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide
Compound characteristics
| Compound ID: | S233-2068 |
| Compound Name: | 2-(3-methyl-1H-pyrazol-1-yl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}acetamide |
| Molecular Weight: | 332.44 |
| Molecular Formula: | C18 H28 N4 O2 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCC)=O)CNC(Cn1ccc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2954 |
| logD: | 1.2954 |
| logSw: | -2.097 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.447 |
| InChI Key: | MJGRYAPIFFTHIF-QAPCUYQASA-N |