3-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-methylbenzamide
Chemical Structure Depiction of
3-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-methylbenzamide
3-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | S823-1574 |
| Compound Name: | 3-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-methylbenzamide |
| Molecular Weight: | 336.4 |
| Molecular Formula: | C18 H25 F N2 O3 |
| Smiles: | Cc1ccc(cc1F)C(N[C@@H]1CN(C[C@H]1CO)C1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3463 |
| logD: | -1.2638 |
| logSw: | -2.0321 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.117 |
| InChI Key: | BZAWXTLABSYPSG-PBHICJAKSA-N |