N-[(3S,5S)-1-(3-fluoropyridine-4-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(3-fluoropyridine-4-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]acetamide
N-[(3S,5S)-1-(3-fluoropyridine-4-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | SB18-0561 |
| Compound Name: | N-[(3S,5S)-1-(3-fluoropyridine-4-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 394.41 |
| Molecular Formula: | C20 H19 F N6 O2 |
| Smiles: | CC(N[C@H]1C[C@@H](c2nc(c3ccccc3)n[nH]2)N(C1)C(c1ccncc1F)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6514 |
| logD: | 1.6452 |
| logSw: | -1.8979 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.029 |
| InChI Key: | CLIGJNNVQMQKLY-PBHICJAKSA-N |