N-[(3S,5S)-1-(5-fluoropyridine-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(5-fluoropyridine-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide
N-[(3S,5S)-1-(5-fluoropyridine-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide
Compound characteristics
| Compound ID: | SB18-0682 |
| Compound Name: | N-[(3S,5S)-1-(5-fluoropyridine-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide |
| Molecular Weight: | 424.43 |
| Molecular Formula: | C21 H21 F N6 O3 |
| Smiles: | COCC(N[C@H]1C[C@@H](c2nc(c3ccccc3)n[nH]2)N(C1)C(c1ccc(cn1)F)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6866 |
| logD: | 1.6804 |
| logSw: | -1.9288 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.959 |
| InChI Key: | NLZQIQMTZZVAKB-WBVHZDCISA-N |