1-[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]-3-methylbutan-1-one
1-[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]-3-methylbutan-1-one
Compound characteristics
| Compound ID: | SB29-0272 |
| Compound Name: | 1-[(2S,4S)-4-(benzyloxy)-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]-3-methylbutan-1-one |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | CC(C)CC(N1C[C@H](C[C@H]1c1nc(C)[nH]n1)OCc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8586 |
| logD: | 2.8572 |
| logSw: | -3.1593 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.764 |
| InChI Key: | FFNVJDHBRWNEQY-SJORKVTESA-N |