rel-(4aR,8aS)-1-(2-methoxyethyl)-6-(1-methyl-1H-pyrrole-2-carbonyl)-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-1-(2-methoxyethyl)-6-(1-methyl-1H-pyrrole-2-carbonyl)-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
rel-(4aR,8aS)-1-(2-methoxyethyl)-6-(1-methyl-1H-pyrrole-2-carbonyl)-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | SB17-0760 |
| Compound Name: | rel-(4aR,8aS)-1-(2-methoxyethyl)-6-(1-methyl-1H-pyrrole-2-carbonyl)-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C21 H32 N4 O4 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2CCOC)=O)C(NC(C)C)=O)C(c1cccn1C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2151 |
| logD: | 1.2151 |
| logSw: | -2.1298 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.222 |
| InChI Key: | UZFUBOULKWZJTM-UTKZUKDTSA-N |