2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]acrylamide
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]acrylamide
Compound characteristics
| Compound ID: | 4277-0475 |
| Compound Name: | 2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]acrylamide |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C25 H26 N4 O4 S |
| Smiles: | CC(C)Cc1nnc(NC(C(=C/c2ccc(c(c2)OC)OCCOc2ccccc2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.19 |
| logD: | 3.26 |
| logSw: | -6.01 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 173.01 |
| InChI Key: | HVJCLVQIIKQWES-UHFFFAOYSA-N |