3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 2542-3851 |
| Compound Name: | 3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile |
| Molecular Weight: | 457.93 |
| Molecular Formula: | C22 H20 Cl N3 O4 S |
| Smiles: | COc1cc(c(cc1N/C=C(/C#N)c1nc(cs1)c1ccc(c(c1)OC)OC)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1314 |
| logD: | 5.1264 |
| logSw: | -5.8631 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.182 |
| InChI Key: | FJKOVBCLBZFBMJ-UHFFFAOYSA-N |