N-benzyl-1-({(2S,4S)-4-fluoro-1-[(2-methylpropyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(2-methylpropyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(2-methylpropyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1714 |
| Compound Name: | N-benzyl-1-({(2S,4S)-4-fluoro-1-[(2-methylpropyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C20 H27 F N6 O2 |
| Smiles: | CC(C)CNC(N1C[C@H](C[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.9619 |
| logD: | 1.9618 |
| logSw: | -2.1207 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.173 |
| InChI Key: | KHBVNOLQYCQXAR-DLBZAZTESA-N |