1-({(2S,4S)-1-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-1-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-1-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0908 |
| Compound Name: | 1-({(2S,4S)-1-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 345.37 |
| Molecular Formula: | C17 H20 F N5 O2 |
| Smiles: | C1COc2ccc(CN3C[C@H](C[C@H]3Cn3cc(C(N)=O)nn3)F)cc12 |
| Stereo: | ABSOLUTE |
| logP: | 0.747 |
| logD: | 0.722 |
| logSw: | -1.6873 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.892 |
| InChI Key: | JSQVWSDTUNEIPZ-UONOGXRCSA-N |