propyl rel-(3aR,8bR)-10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate
Chemical Structure Depiction of
propyl rel-(3aR,8bR)-10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate
propyl rel-(3aR,8bR)-10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate
Compound characteristics
| Compound ID: | 8010-5039 |
| Compound Name: | propyl rel-(3aR,8bR)-10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate |
| Molecular Weight: | 352.34 |
| Molecular Formula: | C19 H16 N2 O5 |
| Smiles: | CCCOC(C1=C(C)O[C@@]23c4ccccc4C([C@@]12C(C#N)=C(N)O3)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4805 |
| logD: | 2.4805 |
| logSw: | -2.8117 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.701 |
| InChI Key: | XHPDNVGMLNDLMK-RTBURBONSA-N |