1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]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-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1459 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[4-(1H-indol-3-yl)butanoyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C23 H29 F N6 O2 |
| Smiles: | CC(C)NC(c1cn(C[C@@H]2C[C@@H](CN2C(CCCc2c[nH]c3ccccc23)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.186 |
| logD: | 2.186 |
| logSw: | -2.4977 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.348 |
| InChI Key: | CNZWMOHQZOVNCC-ZWKOTPCHSA-N |