3-[2-(benzyloxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[2-(benzyloxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[2-(benzyloxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-3693 |
| Compound Name: | 3-[2-(benzyloxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C22 H20 N4 O2 S |
| Smiles: | CCCc1nnc(NC(C(=C/c2ccccc2OCc2ccccc2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.44 |
| logD: | 3.81 |
| logSw: | -6.11 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 135.84 |
| InChI Key: | KRWRUXBUFYPZTM-UHFFFAOYSA-N |