N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | S823-6794 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide |
| Molecular Weight: | 326.4 |
| Molecular Formula: | C18 H22 N4 O2 |
| Smiles: | Cc1cccc(CN2C[C@H]([C@@H](C2)CO)NC(c2cnccn2)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8614 |
| logD: | -1.1385 |
| logSw: | -1.4418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.221 |
| InChI Key: | ICTHZQIUNXTGQK-WBVHZDCISA-N |