N-benzyl-1-({(2S,4S)-4-fluoro-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0411 |
| Compound Name: | N-benzyl-1-({(2S,4S)-4-fluoro-1-[(pyridin-3-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C22 H23 F N6 O2 |
| Smiles: | C(C(N1C[C@H](C[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)F)=O)c1cccnc1 |
| Stereo: | ABSOLUTE |
| logP: | 1.0515 |
| logD: | 1.0429 |
| logSw: | -1.0532 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.749 |
| InChI Key: | NNRNLZXIIGAMJO-RBUKOAKNSA-N |