1-{[(2S,4S)-1-(4-ethoxybenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(4-ethoxybenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(4-ethoxybenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1348 |
| Compound Name: | 1-{[(2S,4S)-1-(4-ethoxybenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C16 H20 F N5 O4 S |
| Smiles: | CCOc1ccc(cc1)S(N1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7893 |
| logD: | 0.7893 |
| logSw: | -2.4038 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.368 |
| InChI Key: | RRSMDUVEIXZKTK-NEPJUHHUSA-N |