N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-2-hydroxypyridine-3-carboxamide
Chemical Structure Depiction of
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-2-hydroxypyridine-3-carboxamide
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-2-hydroxypyridine-3-carboxamide
Compound characteristics
| Compound ID: | S233-2118 |
| Compound Name: | N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-2-hydroxypyridine-3-carboxamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C22 H25 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2Cc1ccccc1)=O)CNC(c1cccnc1O)=O |
| Stereo: | RELATIVE |
| logP: | 1.921 |
| logD: | 1.8722 |
| logSw: | -2.7548 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.952 |
| InChI Key: | YETGBSAMCKPDFG-GCJKJVERSA-N |