rel-(4aR,8aS)-N-benzyl-6-(butane-1-sulfonyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-N-benzyl-6-(butane-1-sulfonyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide
rel-(4aR,8aS)-N-benzyl-6-(butane-1-sulfonyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | SB17-0320 |
| Compound Name: | rel-(4aR,8aS)-N-benzyl-6-(butane-1-sulfonyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C20 H29 N3 O4 S |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2)=O)C(NCc1ccccc1)=O)S(CCCC)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4313 |
| logD: | 1.4313 |
| logSw: | -2.3588 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.893 |
| InChI Key: | YCRAAUOGXGGTMV-PXNSSMCTSA-N |