rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(thiophen-3-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(thiophen-3-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(thiophen-3-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0871 |
| Compound Name: | rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(thiophen-3-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | Cc1cccc(c1)[C@@]1(C[C@@H]2CCC(N2C1)=O)C(NCc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4043 |
| logD: | 2.4043 |
| logSw: | -2.7312 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.945 |
| InChI Key: | ZRDIVSAESBWSPU-FXAWDEMLSA-N |