rel-(2R,7aS)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0409 |
| Compound Name: | rel-(2R,7aS)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C21 H25 N3 O4 |
| Smiles: | Cc1c(CNC([C@]2(C[C@@H]3CCC(N3C2)=O)c2cccc(c2)OC)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6142 |
| logD: | 1.6142 |
| logSw: | -2.279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.509 |
| InChI Key: | VRRYRJMOYGUFCZ-HRAATJIYSA-N |