2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}pyridine
Chemical Structure Depiction of
2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}pyridine
2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}pyridine
Compound characteristics
| Compound ID: | SB29-0221 |
| Compound Name: | 2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}pyridine |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C20 H23 N5 O |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2Cc2ccccn2)OCc2ccccc2)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 2.1138 |
| logD: | 2.1075 |
| logSw: | -2.3176 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.812 |
| InChI Key: | PLQUESMQPFUWHG-RBUKOAKNSA-N |