2-cyano-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-0928 |
| Compound Name: | 2-cyano-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 466.53 |
| Molecular Formula: | C24 H23 F N4 O3 S |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2nnc(C(C)C)s2)=O)ccc1OCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.94 |
| logD: | 3.03 |
| logSw: | -5.69 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 147.98 |
| InChI Key: | CJSBCTMWNAEZKL-UHFFFAOYSA-N |