N-[(3S,5S)-1-(3-fluoro-4-methylbenzoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(3-fluoro-4-methylbenzoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide
N-[(3S,5S)-1-(3-fluoro-4-methylbenzoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide
Compound characteristics
| Compound ID: | SB18-0678 |
| Compound Name: | N-[(3S,5S)-1-(3-fluoro-4-methylbenzoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]-2-methoxyacetamide |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C23 H24 F N5 O3 |
| Smiles: | Cc1ccc(cc1F)C(N1C[C@H](C[C@H]1c1nc(c2ccccc2)n[nH]1)NC(COC)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8202 |
| logD: | 2.814 |
| logSw: | -3.2739 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.822 |
| InChI Key: | DTJQBXXHNQMOPK-MJGOQNOKSA-N |