2-{1-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{1-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
2-{1-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y501-3127 |
| Compound Name: | 2-{1-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 382.35 |
| Molecular Formula: | C19 H15 F N4 O4 |
| Smiles: | COc1ccc2C(N(C(c2c1OC)=O)c1ncn(Cc2cccc(c2)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9079 |
| logD: | 1.9079 |
| logSw: | -2.8188 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.242 |
| InChI Key: | KSVIBKCNZWQGTA-UHFFFAOYSA-N |