rel-(3R,4R)-1-(3-fluoro-4-methylbenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(3-fluoro-4-methylbenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-(3-fluoro-4-methylbenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-3795 |
| Compound Name: | rel-(3R,4R)-1-(3-fluoro-4-methylbenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 308.35 |
| Molecular Formula: | C16 H21 F N2 O3 |
| Smiles: | Cc1ccc(cc1F)C(N1C[C@@H](COC)[C@@H](C1)C(NC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9597 |
| logD: | 0.9597 |
| logSw: | -2.2231 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.379 |
| InChI Key: | MFGUBHCJNJFKGI-QWHCGFSZSA-N |