N~1~-{2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl}-N~2~-(3-nitrophenyl)ethanediamide
Chemical Structure Depiction of
N~1~-{2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl}-N~2~-(3-nitrophenyl)ethanediamide
N~1~-{2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl}-N~2~-(3-nitrophenyl)ethanediamide
Compound characteristics
| Compound ID: | G856-3067 |
| Compound Name: | N~1~-{2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]ethyl}-N~2~-(3-nitrophenyl)ethanediamide |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | Cc1cccc(c1)c1nc(C)c(CCNC(C(Nc2cccc(c2)[N+]([O-])=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.1198 |
| logD: | 2.1341 |
| logSw: | -4.2714 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.548 |
| InChI Key: | CFRCDCYUPPCFRX-UHFFFAOYSA-N |