5-(3-fluorophenyl)-4-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(3-fluorophenyl)-4-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(3-fluorophenyl)-4-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 6220-1307 |
| Compound Name: | 5-(3-fluorophenyl)-4-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C19 H19 F N4 S |
| Smiles: | C1CCN(C1)CN1C(N(C(c2cccc(c2)F)=N1)c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.8191 |
| logD: | 2.4377 |
| logSw: | -4.0943 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.0191 |
| InChI Key: | QLOVLXURLDQEQS-UHFFFAOYSA-N |