N-benzyl-1-({(2S,4S)-4-fluoro-1-[(propan-2-yl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(propan-2-yl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(propan-2-yl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0418 |
| Compound Name: | N-benzyl-1-({(2S,4S)-4-fluoro-1-[(propan-2-yl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C19 H25 F N6 O2 |
| Smiles: | CC(C)NC(N1C[C@H](C[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6729 |
| logD: | 1.6729 |
| logSw: | -1.7835 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.148 |
| InChI Key: | ACYSISLIWWGCFW-JKSUJKDBSA-N |