3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}-3-chloro-5-ethoxyphenyl)-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}-3-chloro-5-ethoxyphenyl)-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}-3-chloro-5-ethoxyphenyl)-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C469-0278 |
| Compound Name: | 3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}-3-chloro-5-ethoxyphenyl)-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 542.01 |
| Molecular Formula: | C25 H24 Cl N5 O5 S |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2nnc(C)s2)=O)cc(c1OCCOc1ccc(cc1)NC(C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.98 |
| logD: | 2.03 |
| logSw: | -5.02 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 209.93 |
| InChI Key: | RLPVAASIKFXBHU-UHFFFAOYSA-N |