3-[3-chloro-5-ethoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[3-chloro-5-ethoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[3-chloro-5-ethoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-1360 |
| Compound Name: | 3-[3-chloro-5-ethoxy-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 513.01 |
| Molecular Formula: | C25 H25 Cl N4 O4 S |
| Smiles: | CCCc1nnc(NC(C(=C/c2cc(c(c(c2)[Cl])OCCOc2ccccc2)OCC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.05 |
| logD: | 4.12 |
| logSw: | -7.07 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 161.59 |
| InChI Key: | DULLEKDQBLSKOD-UHFFFAOYSA-N |