1-{[(2S,4S)-1-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1243 |
| Compound Name: | 1-{[(2S,4S)-1-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 371.39 |
| Molecular Formula: | C13 H18 F N7 O3 S |
| Smiles: | Cc1nc(cn1C)S(N1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -1.0897 |
| logD: | -1.0897 |
| logSw: | -1.0611 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.594 |
| InChI Key: | YRWNXNKGRYYNCE-ZJUUUORDSA-N |