N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}benzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}benzamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}benzamide
Compound characteristics
| Compound ID: | S823-2722 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}benzamide |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C18 H23 N3 O2 |
| Smiles: | Cn1cccc1CN1C[C@H]([C@@H](C1)CO)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.186 |
| logD: | 0.3665 |
| logSw: | -1.7972 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.553 |
| InChI Key: | JLUOONATIXGIGD-WBVHZDCISA-N |