rel-(4aR,8aS)-N-benzyl-2-oxo-6-(thiophene-3-carbonyl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-N-benzyl-2-oxo-6-(thiophene-3-carbonyl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
rel-(4aR,8aS)-N-benzyl-2-oxo-6-(thiophene-3-carbonyl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | SB17-0390 |
| Compound Name: | rel-(4aR,8aS)-N-benzyl-2-oxo-6-(thiophene-3-carbonyl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2)=O)C(NCc1ccccc1)=O)C(c1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4331 |
| logD: | 1.4331 |
| logSw: | -2.3074 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.683 |
| InChI Key: | HUNWDIXUMXZTQU-UWJYYQICSA-N |