N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}pyridine-3-carboxamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S823-7468 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]pyrrolidin-3-yl}pyridine-3-carboxamide |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | Cn1cccc1CN1C[C@H]([C@@H](C1)CO)NC(c1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.103 |
| logD: | -0.7164 |
| logSw: | -0.8855 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.071 |
| InChI Key: | HKMLTJLFBBFKHR-ZBFHGGJFSA-N |