rel-(2R,7aS)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-2-phenylhexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-2-phenylhexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-2-phenylhexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0377 |
| Compound Name: | rel-(2R,7aS)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-2-phenylhexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C20 H22 N2 O3 |
| Smiles: | Cc1ccc(CNC([C@]2(C[C@@H]3CCC(N3C2)=O)c2ccccc2)=O)o1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4088 |
| logD: | 2.4088 |
| logSw: | -2.6263 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.189 |
| InChI Key: | KQCQQVNMVDBPDR-OXJNMPFZSA-N |