N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-4-methyl-1,3-oxazole-5-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-4-methyl-1,3-oxazole-5-carboxamide
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-4-methyl-1,3-oxazole-5-carboxamide
Compound characteristics
| Compound ID: | S639-0416 |
| Compound Name: | N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-4-methyl-1,3-oxazole-5-carboxamide |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | Cc1c(C(N[C@@H]2CN(Cc3ccccc3)C[C@H]2CN(C)C)=O)ocn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0255 |
| logD: | -1.0412 |
| logSw: | -1.8491 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.342 |
| InChI Key: | PSECJCYTNOOUTB-IRXDYDNUSA-N |