2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)prop-2-enenitrile
2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 1246-1075 |
| Compound Name: | 2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(3,4-dimethoxyphenyl)prop-2-enenitrile |
| Molecular Weight: | 417.31 |
| Molecular Formula: | C20 H14 Cl2 N2 O2 S |
| Smiles: | COc1ccc(\C=C(/C#N)c2nc(cs2)c2ccc(c(c2)[Cl])[Cl])cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.1963 |
| logD: | 6.1963 |
| logSw: | -6.4922 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.018 |
| InChI Key: | OBIPWGIUECOCEE-UHFFFAOYSA-N |