1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1009 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C22 H27 F N6 O2 |
| Smiles: | CN(C)C(c1cn(C[C@@H]2C[C@@H](CN2C(CCCc2c[nH]c3ccccc23)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1168 |
| logD: | 1.1168 |
| logSw: | -1.9825 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.69 |
| InChI Key: | TVTDTZRPEOVEQI-DLBZAZTESA-N |