1-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}pyrrolidine-2,5-dione
Chemical Structure Depiction of
1-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}pyrrolidine-2,5-dione
1-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | Y503-3613 |
| Compound Name: | 1-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}pyrrolidine-2,5-dione |
| Molecular Weight: | 308.7 |
| Molecular Formula: | C13 H10 Cl F N4 O2 |
| Smiles: | C1CC(N(C1=O)c1ncn(Cc2ccc(cc2[Cl])F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1256 |
| logD: | 1.1256 |
| logSw: | -2.5448 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.721 |
| InChI Key: | AWNIJLUFZZNNSD-UHFFFAOYSA-N |