3-[(2S,4S)-4-(benzyloxy)-1-cyclohexylpyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
Chemical Structure Depiction of
3-[(2S,4S)-4-(benzyloxy)-1-cyclohexylpyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
3-[(2S,4S)-4-(benzyloxy)-1-cyclohexylpyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB29-0213 |
| Compound Name: | 3-[(2S,4S)-4-(benzyloxy)-1-cyclohexylpyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole |
| Molecular Weight: | 340.47 |
| Molecular Formula: | C20 H28 N4 O |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C2CCCCC2)OCc2ccccc2)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 3.7732 |
| logD: | 3.7267 |
| logSw: | -3.8529 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.657 |
| InChI Key: | MTKMZNKFJAUVCF-RBUKOAKNSA-N |