3-(4-fluorophenyl)-5-[(2S)-1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-fluorophenyl)-5-[(2S)-1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole
3-(4-fluorophenyl)-5-[(2S)-1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P930-5527 |
| Compound Name: | 3-(4-fluorophenyl)-5-[(2S)-1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]-4H-1,2,4-triazole |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C19 H19 F N4 O3 S |
| Smiles: | COc1cccc(c1)S(N1CCC[C@H]1c1nnc(c2ccc(cc2)F)[nH]1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7656 |
| logD: | 2.73 |
| logSw: | -3.3564 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.843 |
| InChI Key: | NFQUISDIIFNHCW-KRWDZBQOSA-N |