3-[(2S,4S)-4-(benzyloxy)-1-(cyclopropanesulfonyl)pyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
Chemical Structure Depiction of
3-[(2S,4S)-4-(benzyloxy)-1-(cyclopropanesulfonyl)pyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
3-[(2S,4S)-4-(benzyloxy)-1-(cyclopropanesulfonyl)pyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB29-0217 |
| Compound Name: | 3-[(2S,4S)-4-(benzyloxy)-1-(cyclopropanesulfonyl)pyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C17 H22 N4 O3 S |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2S(C2CC2)(=O)=O)OCc2ccccc2)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 1.8932 |
| logD: | 1.8917 |
| logSw: | -2.3874 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.382 |
| InChI Key: | MLZGDFWJGIEYMR-ZBFHGGJFSA-N |