5-(3-methylphenyl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
5-(3-methylphenyl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-oxazole-4-carboxamide
5-(3-methylphenyl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | S233-1976 |
| Compound Name: | 5-(3-methylphenyl)-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C23 H29 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCC)=O)CNC(c1c(c2cccc(C)c2)ocn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.32 |
| logD: | 3.32 |
| logSw: | -3.4271 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.03 |
| InChI Key: | CGTHVLMBQKFXOL-JPYJTQIMSA-N |