rel-(3R,4R)-1-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-2302 |
| Compound Name: | rel-(3R,4R)-1-(4-fluoro-3-methylbenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C14 H19 F N2 O4 S |
| Smiles: | Cc1cc(ccc1F)S(N1C[C@@H](COC)[C@@H](C1)C(N)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9302 |
| logD: | 0.9302 |
| logSw: | -2.5866 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.665 |
| InChI Key: | ZGVRJVIRWMRXSY-CMPLNLGQSA-N |