N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl}benzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl}benzamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl}benzamide
Compound characteristics
| Compound ID: | S823-2893 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl}benzamide |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | Cc1ccc(CN2C[C@H]([C@@H](C2)CO)NC(c2ccccc2)=O)o1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.549 |
| logD: | -0.3229 |
| logSw: | -1.9436 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.918 |
| InChI Key: | YOMCNISOALJNAP-WBVHZDCISA-N |