N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[3-(2-phenoxyethoxy)phenyl]acrylamide
Chemical Structure Depiction of
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[3-(2-phenoxyethoxy)phenyl]acrylamide
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[3-(2-phenoxyethoxy)phenyl]acrylamide
Compound characteristics
| Compound ID: | 4272-0030 |
| Compound Name: | N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[3-(2-phenoxyethoxy)phenyl]acrylamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | CCCCc1nnc(NC(C(=C/c2cccc(c2)OCCOc2ccccc2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.63 |
| logD: | 3.7 |
| logSw: | -6.23 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 167.18 |
| InChI Key: | LZNHZPGUFJQRJK-UHFFFAOYSA-N |