2-cyano-3-{3-iodo-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-iodo-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{3-iodo-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3797-1349 |
| Compound Name: | 2-cyano-3-{3-iodo-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 620.47 |
| Molecular Formula: | C25 H25 I N4 O5 S |
| Smiles: | CC(C)c1nnc(NC(C(=C/c2cc(c(c(c2)I)OCCOc2ccccc2OC)OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.47 |
| logD: | 3.56 |
| logSw: | -6.59 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 169.43 |
| InChI Key: | DFBWPRJYPWEYOF-UHFFFAOYSA-N |