2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}acrylamide
2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}acrylamide
Compound characteristics
| Compound ID: | 3773-0524 |
| Compound Name: | 2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}acrylamide |
| Molecular Weight: | 509.54 |
| Molecular Formula: | C24 H23 N5 O6 S |
| Smiles: | CC(C)c1nnc(NC(C(=C/c2ccc(c(c2)OC)OCCOc2ccc(cc2)[N+]([O-])=O)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.68 |
| logD: | 2.77 |
| logSw: | -5.43 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 257.94 |
| InChI Key: | ASACFIUIZPOFAQ-UHFFFAOYSA-N |