1-({(2S,4S)-4-fluoro-1-[5-(3-methylphenyl)-1,3-oxazole-4-carbonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-4-fluoro-1-[5-(3-methylphenyl)-1,3-oxazole-4-carbonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[5-(3-methylphenyl)-1,3-oxazole-4-carbonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0158 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[5-(3-methylphenyl)-1,3-oxazole-4-carbonyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 440.48 |
| Molecular Formula: | C22 H25 F N6 O3 |
| Smiles: | CC(C)NC(c1cn(C[C@@H]2C[C@@H](CN2C(c2c(c3cccc(C)c3)ocn2)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.889 |
| logD: | 1.889 |
| logSw: | -2.2321 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.841 |
| InChI Key: | YTGNVXQUMXRPFH-DLBZAZTESA-N |