1-{[(2S,4S)-1-(4-acetamidobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(4-acetamidobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(4-acetamidobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1322 |
| Compound Name: | 1-{[(2S,4S)-1-(4-acetamidobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 374.37 |
| Molecular Formula: | C17 H19 F N6 O3 |
| Smiles: | CC(Nc1ccc(cc1)C(N1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.3678 |
| logD: | -0.368 |
| logSw: | -1.582 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.666 |
| InChI Key: | FMAKYORCROULPT-GXTWGEPZSA-N |