N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-6-hydroxypyridine-3-carboxamide
Chemical Structure Depiction of
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-6-hydroxypyridine-3-carboxamide
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-6-hydroxypyridine-3-carboxamide
Compound characteristics
| Compound ID: | S233-2078 |
| Compound Name: | N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-6-hydroxypyridine-3-carboxamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C22 H25 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2Cc1ccccc1)=O)CNC(c1ccc(nc1)O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9767 |
| logD: | 1.7519 |
| logSw: | -2.2827 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.34 |
| InChI Key: | RWYZLYDGZRGCAG-GCJKJVERSA-N |