rel-(4aR,8aS)-N-benzyl-6-(cyclopropylmethyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-N-benzyl-6-(cyclopropylmethyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide
rel-(4aR,8aS)-N-benzyl-6-(cyclopropylmethyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | SB17-0391 |
| Compound Name: | rel-(4aR,8aS)-N-benzyl-6-(cyclopropylmethyl)-2-oxooctahydro-1,6-naphthyridine-4a(2H)-carboxamide |
| Molecular Weight: | 341.45 |
| Molecular Formula: | C20 H27 N3 O2 |
| Smiles: | [H][C@@]12CCN(CC3CC3)C[C@]1(CCC(N2)=O)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5559 |
| logD: | -1.3446 |
| logSw: | -2.0329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.272 |
| InChI Key: | MPMIKJLWEDRPDY-XLIONFOSSA-N |