N~1~-{2-[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-N~2~-(4-nitrophenyl)ethanediamide
Chemical Structure Depiction of
N~1~-{2-[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-N~2~-(4-nitrophenyl)ethanediamide
N~1~-{2-[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-N~2~-(4-nitrophenyl)ethanediamide
Compound characteristics
| Compound ID: | G856-3032 |
| Compound Name: | N~1~-{2-[2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-N~2~-(4-nitrophenyl)ethanediamide |
| Molecular Weight: | 470.5 |
| Molecular Formula: | C22 H22 N4 O6 S |
| Smiles: | Cc1c(CCNC(C(Nc2ccc(cc2)[N+]([O-])=O)=O)=O)sc(c2ccc(c(c2)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2309 |
| logD: | 0.9369 |
| logSw: | -3.6728 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.809 |
| InChI Key: | JXZXZZNFFANSHX-UHFFFAOYSA-N |