rel-(4aR,8aS)-N-benzyl-2-oxo-6-[(thiophen-3-yl)acetyl]octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-N-benzyl-2-oxo-6-[(thiophen-3-yl)acetyl]octahydro-1,6-naphthyridine-4a(2H)-carboxamide
rel-(4aR,8aS)-N-benzyl-2-oxo-6-[(thiophen-3-yl)acetyl]octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | SB17-0358 |
| Compound Name: | rel-(4aR,8aS)-N-benzyl-2-oxo-6-[(thiophen-3-yl)acetyl]octahydro-1,6-naphthyridine-4a(2H)-carboxamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2)=O)C(NCc1ccccc1)=O)C(Cc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7377 |
| logD: | 1.7377 |
| logSw: | -2.3393 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.155 |
| InChI Key: | XRAYHLAPWHQNPP-AVRDEDQJSA-N |