2-(2-fluorophenyl)-1-[(2S,4S)-4-fluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(2-fluorophenyl)-1-[(2S,4S)-4-fluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]ethan-1-one
2-(2-fluorophenyl)-1-[(2S,4S)-4-fluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | SB21-1147 |
| Compound Name: | 2-(2-fluorophenyl)-1-[(2S,4S)-4-fluoro-2-{[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 403.43 |
| Molecular Formula: | C20 H23 F2 N5 O2 |
| Smiles: | C1CCN(C1)C(c1cn(C[C@@H]2C[C@@H](CN2C(Cc2ccccc2F)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8015 |
| logD: | 1.8015 |
| logSw: | -1.831 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.833 |
| InChI Key: | AAOIHYMHDYDPEI-CVEARBPZSA-N |