3-[(2S)-1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-2-yl]-5-(4-fluorophenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[(2S)-1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-2-yl]-5-(4-fluorophenyl)-4H-1,2,4-triazole
3-[(2S)-1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-2-yl]-5-(4-fluorophenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P930-5636 |
| Compound Name: | 3-[(2S)-1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-2-yl]-5-(4-fluorophenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C17 H19 F N6 O2 S |
| Smiles: | CCn1cc(cn1)S(N1CCC[C@H]1c1nnc(c2ccc(cc2)F)[nH]1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.2417 |
| logD: | 1.2061 |
| logSw: | -2.2444 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.801 |
| InChI Key: | NYADRRQMMPLLDY-HNNXBMFYSA-N |