2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}-6-methoxypyridine
Chemical Structure Depiction of
2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}-6-methoxypyridine
2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}-6-methoxypyridine
Compound characteristics
| Compound ID: | SB29-0279 |
| Compound Name: | 2-{[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methyl}-6-methoxypyridine |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C21 H25 N5 O2 |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2Cc2cccc(n2)OC)OCc2ccccc2)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 2.954 |
| logD: | 2.9326 |
| logSw: | -3.0816 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.825 |
| InChI Key: | DQFQWJZKHDHYDM-RBUKOAKNSA-N |